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SMILES synton_id synton# reaction_id
O=C(NC1COC1)[1*] 277310376-742385846 0 urea-3
Oc(cc(cc1)NC([1*])=O)c1Cl 287123986-010598048 0 urea-3
O=C(NCC1C(C2)C2CCC1)[1*] 245596878-277766080 0 urea-3
O=C(NC1(CC2CC2)CCC1)[1*] 016642174-703335348 0 urea-3
O=C(N1C[C@H](CC2)O[C@H]2C1)[1*] 392541939-182447835 0 urea-3
Cc1ccn[n]1CCNC([1*])=O 529398800-379230850 0 urea-3
COC(CN(C1CC1)C([1*])=O)=O 895936729-549198517 0 urea-3
O=C(N(C1CC1)C1CCC1)[1*] 969311981-119479931 0 urea-3
OCCCC(C(O)=O)NC([1*])=O 165639936-133470734 0 urea-3
CN(Cc([s]cc1)c1Br)C([1*])=O 797045487-012313439 0 urea-3
CCC(CC)(CNC([1*])=O)CO 217429287-784394165 0 urea-3
C[C@H]1N(C)[C@@H](CNC([1*])=O)CC1 633064842-782867844 0 urea-3
O=C(NCCOCC1CC1)[1*] 217206902-756393796 0 urea-3
NC(NC(CCNC([1*])=O)=O)=O 888118853-423043383 0 urea-3
O=C(NC(CCO1)C1=O)[1*] 526753034-918382212 0 urea-3
C[C@H](C(C(O)=O)NC([1*])=O)F 323473508-780713002 0 urea-3
O=C(N(CCOC1)C1C(F)F)[1*] 261092033-843094477 0 urea-3
CSc1ccc(CNC([1*])=O)[s]1 866107617-688358381 0 urea-3
Nc1cc(NC([1*])=O)cc(Cl)n1 929856022-720297464 0 urea-3
CC(CC1)CC1N(C)C([1*])=O 853917427-375672193 0 urea-3
O=C(Nc1c(CN[1*])cc[s]1)[2*] 584456271-623025187 1 urea-3
C[C@H](CC(C1)N[1*])CN1C([2*])=O 182115391-684092275 1 urea-3
O=C(N(CCC1N[1*])C[C@@H]1F)[2*] 050413332-848501730 1 urea-3
O=C(NCC(CCC1)C1N[1*])[2*] 955379205-152037395 1 urea-3
CC(CNC([2*])=O)(CO)N[1*] 711002235-406213687 1 urea-3
O=C(NC1[C@H](CN[1*])CCC1)[2*] 524410683-122879223 1 urea-3
CC(CCN[1*])N(C)C([2*])=O 897633396-429181350 1 urea-3
C[C@@H](CN(C1)C([2*])=O)C1N[1*] 494730607-371477059 1 urea-3
O=C(NCC1(CN[1*])COC1)[2*] 556610661-025062707 1 urea-3
C[n]1ncc(N[1*])c1NC([2*])=O 502134096-989491390 1 urea-3
O=C(NC[C@H](COC1)C1N[1*])[2*] 869118906-071030508 1 urea-3
O=C(NC1(CN[1*])COCC1)[2*] 344296927-571785683 1 urea-3
OC(C(CN[1*])NC([2*])=O)=O 458160963-784510603 1 urea-3
CN(CC1(CC1)N[1*])C([2*])=O 009516132-856691534 1 urea-3
O=C(NCC(CN[1*])(F)F)[2*] 363472647-015412039 1 urea-3
O=C(NCC1C(CN[1*])C1)[2*] 704577189-439835881 1 urea-3
CCC(CCN[1*])NC([2*])=O 327461031-374421579 1 urea-3
O=C(NCC1(CN[1*])CC1)[2*] 814448456-756141738 1 urea-3
CC(CN[1*])N(C)C([2*])=O 143741321-025339543 1 urea-3
OC(CCN[1*])(C1)CN1C([2*])=O 988230432-152034926 1 urea-3
FC(Oc(cc1)cnc1[2*])F 441848376-976230122 2 urea-3
Fc1nccnc1[2*] 487354835-896308859 2 urea-3
CC(NCc1cccc([2*])c1)=O 580333624-335748986 2 urea-3
[O-][N+](c1c(C=O)ccc([2*])c1)=O 584672617-895389367 2 urea-3
COc1c(C(F)F)ccc([2*])c1 407725808-777855966 2 urea-3
Fc(cc1)c2NCCc2c1[2*] 735644110-408768960 2 urea-3
[O-][N+](c1cc(C=O)cnc1[2*])=O 026126927-118286143 2 urea-3
NCc(cc1)cc(F)c1[2*] 329511511-081418203 2 urea-3
N#CCc1c[s]c([2*])n1 758738500-125299082 2 urea-3
Nc(cc(c([2*])c1F)F)c1N 754923683-146746987 2 urea-3
OS(c(cc(cc1)F)c1[2*])=O 790844648-992756250 2 urea-3
Cc(c([2*])c1C(Cl)=O)ccc1F 266006087-843379435 2 urea-3
Oc(cccc1)c1[2*] 795584461-057380287 2 urea-3
CC(c(ccc([2*])c1)c1F)(F)F 038550330-112003896 2 urea-3
CSc1cc([2*])cnc1 480960913-929968801 2 urea-3
[2*]c(cc1)nnc1-[n]1cccc1 670899150-893086912 2 urea-3
CSc1cc(C(O)=O)nc([2*])n1 821136904-635555130 2 urea-3
CC(Cc(cc1)c2cc1[2*])C2=O 928136689-642453505 2 urea-3
[2*]c1nc(-[n]2cncc2)ccc1 979496115-584489947 2 urea-3
N#CCc(cncc1)c1[2*] 689988332-107515102 2 urea-3
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