ethyl 2-[[2-[[4-cycloheptyl-5-(3-morpholin-4-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate
Molecular Formula:
C32H42N6O7S3
InChI: InChI=1/C32H42N6O7S3/c1-5-45-31(41)26-21(2)27(30(40)36(3)4)47-29(26)33-25(39)20-46-32-35-34-28(38(32)23-12-8-6-7-9-13-23)22-11-10-14-24(19-22)48(42,43)37-15-17-44-18-16-37/h10-11,14,19,23H,5-9,12-13,15-18,20H2,1-4H3,(H,33,39)/f/h33H
InChIKey: InChIKey=BGEIXQQXPYJTDD-NSJMMFDCCN
SMILES: CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CSC2=NN=C(N2C3CCCCCC3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5 Names:
ethyl 2-[[2-[[4-cycloheptyl-5-(3-morpholin-4-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Registries:
ChemSpider: InChIKey=BGEIXQQXPYJTDD-NSJMMFDCCN
PubChem CID 4120285
PubChem ID 6049306
InChI: InChI=1/C32H42N6O7S3/c1-5-45-31(41)26-21(2)27(30(40)36(3)4)47-29(26)33-25(39)20-46-32-35-34-28(38(32)23-12-8-6-7-9-13-23)22-11-10-14-24(19-22)48(42,43)37-15-17-44-18-16-37/h10-11,14,19,23H,5-9,12-13,15-18,20H2,1-4H3,(H,33,39)/f/h33H
InChIKey: InChIKey=BGEIXQQXPYJTDD-NSJMMFDCCN
SMILES: CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CSC2=NN=C(N2C3CCCCCC3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5 Names:
ethyl 2-[[2-[[4-cycloheptyl-5-(3-morpholin-4-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Registries:
ChemSpider: InChIKey=BGEIXQQXPYJTDD-NSJMMFDCCN
PubChem CID 4120285
PubChem ID 6049306
