CCOC(=O)C(C)Sc1cnc(NC(=O)N(C2CCCCCC2)C2CCC2)s1
이름: [2-(3-Cycloheptyl-3-cyclobutyl-ureido)-thiazol-5-ylsulfanyl]-propionic acid ethyl ester
IUPAC: ethyl 2-[[2-[[cyclobutyl(cycloheptyl)carbamoyl]amino]-1,3-thiazol-5-yl]sulfanyl]propanoate
SMILES: CCOC(=O)C(C)Sc1cnc(NC(=O)N(C2CCCCCC2)C2CCC2)s1
Canonical SMILES: CCOC(=O)C(C)SC1=CN=C(S1)NC(=O)N(C2CCCCCC2)C3CCC3
분자식: C20H31N3O3S2
분자량: 425.60
InChIKey: CXMVYWGHBGYKIO-UHFFFAOYSA-N
InChI: InChI=1S/C20H31N3O3S2/c1-3-26-18(24)14(2)27-17-13-21-19(28-17)22-20(25)23(16-11-8-12-16)15-9-6-4-5-7-10-15/h13-16H,3-12H2,1-2H3,(H,21,22,25)
PubChem CID: 86611211

동의어

SCHEMBL997995CXMVYWGHBGYKIO-UHFFFAOYSA-N[2-(3-Cycloheptyl-3-cyclobutyl-ureido)-thiazol-5-ylsulfanyl]-propionic acid ethyl ester