ethyl 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-3-(methylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-3-(methylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 2-[[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]amino]-3-(methylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-[[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-3-[(methylcarbamoylamino)-oxomethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]amino]-3-(methylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-[[4-(3,5-dimethylpiperidino)sulfonylbenzoyl]amino]-3-(methylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C27H35N5O7S2 MolecularWeight: 605.7261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC(=O)NC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC(=O)NC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C

InChI

InChI=1S/C27H35N5O7S2/c1-5-39-27(36)31-11-10-20-21(15-31)40-25(22(20)24(34)30-26(35)28-4)29-23(33)18-6-8-19(9-7-18)41(37,38)32-13-16(2)12-17(3)14-32/h6-9,16-17H,5,10-15H2,1-4H3,(H,29,33)(H2,28,30,34,35)