4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(6-propyl-3-pyrrolidin-1-ylcarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(6-propyl-3-pyrrolidin-1-ylcarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[6-propyl-3-(pyrrolidine-1-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-[oxo(1-pyrrolidinyl)methyl]-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[6-propyl-3-(pyrrolidine-1-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[6-propyl-3-(pyrrolidine-1-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]benzamide Formula: C31H36N4O4S2 MolecularWeight: 592.77194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC2=C(C1)SC(=C2C(=O)N3CCCC3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCC6=CC=CC=C6C5

Isomeric SMILES

CCCN1CCC2=C(C1)SC(=C2C(=O)N3CCCC3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C31H36N4O4S2/c1-2-15-33-18-14-26-27(21-33)40-30(28(26)31(37)34-16-5-6-17-34)32-29(36)23-9-11-25(12-10-23)41(38,39)35-19-13-22-7-3-4-8-24(22)20-35/h3-4,7-12H,2,5-6,13-21H2,1H3,(H,32,36)