ethyl N-[[6-propan-2-yl-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-propan-2-yl-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-isopropyl-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-[oxo-[2-[[oxo-[4-[(3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl)sulfonyl]phenyl]methyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-propan-2-yl-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-isopropyl-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: C31H42N4O6S2 MolecularWeight: 630.81838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)C1=C(SC2=C1CCN(C2)C(C)C)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC5(CC4CC(C5)(C)C)C

Isomeric SMILES

CCOC(=O)NC(=O)C1=C(SC2=C1CCN(C2)C(C)C)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC5(CC4CC(C5)(C)C)C

InChI

InChI=1S/C31H42N4O6S2/c1-7-41-29(38)33-27(37)25-23-12-13-34(19(2)3)16-24(23)42-28(25)32-26(36)20-8-10-22(11-9-20)43(39,40)35-18-31(6)15-21(35)14-30(4,5)17-31/h8-11,19,21H,7,12-18H2,1-6H3,(H,32,36)(H,33,37,38)