ethyl N-[[6-ethyl-2-[[4-[(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)sulfonyl]phenyl]carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]carbonyl]carbamate

Systemtic Name: ethyl N-[[6-ethyl-2-[[4-[(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)sulfonyl]phenyl]carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]carbonyl]carbamate Openeye Name: ethyl N-[6-ethyl-2-[[4-[(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)sulfonyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonyl]carbamate CAS Name: N-[[6-ethyl-2-[[oxo-[4-[(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)sulfonyl]phenyl]methyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]-oxomethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-ethyl-2-[[4-[(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)sulfonyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonyl]carbamate Traditional Name: N-[6-ethyl-2-[[4-[(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)sulfonyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonyl]carbamic acid ethyl ester Formula: C30H40N4O6S2 MolecularWeight: 616.7918

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C1)SC(=C2C(=O)NC(=O)OCC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC5(CC4CC(C5)(C)C)C

Isomeric SMILES

CCN1CCC2=C(C1)SC(=C2C(=O)NC(=O)OCC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC5(CC4CC(C5)(C)C)C

InChI

InChI=1S/C30H40N4O6S2/c1-6-33-13-12-22-23(16-33)41-27(24(22)26(36)32-28(37)40-7-2)31-25(35)19-8-10-21(11-9-19)42(38,39)34-18-30(5)15-20(34)14-29(3,4)17-30/h8-11,20H,6-7,12-18H2,1-5H3,(H,31,35)(H,32,36,37)