1-(2-acetamido-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-4-(6-methoxyisoquinolin-1-yl)oxy-pyrrolidine-2-carboxamide

Systemtic Name: 1-(2-acetamido-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-4-(6-methoxyisoquinolin-1-yl)oxy-pyrrolidine-2-carboxamide Openeye Name: 1-(2-acetamido-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-[(6-methoxy-1-isoquinolyl)oxy]pyrrolidine-2-carboxamide CAS Name: 1-(2-acetamido-3,3-dimethyl-1-oxobutyl)-N-[1-[(cyclopropylsulfonylamino)-oxomethyl]-2-ethenylcyclopropyl]-4-[(6-methoxy-1-isoquinolinyl)oxy]-2-pyrrolidinecarboxamide IUPAC Name: 1-(2-acetamido-3,3-dimethylbutanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-4-(6-methoxyisoquinolin-1-yl)oxypyrrolidine-2-carboxamide Traditional Name: 1-(2-acetamido-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-[(6-methoxy-1-isoquinolyl)oxy]pyrrolidine-2-carboxamide Formula: C32H41N5O8S MolecularWeight: 655.76164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)NS(=O)(=O)C3CC3)OC4=NC=CC5=C4C=CC(=C5)OC)C(C)(C)C

Isomeric SMILES

CC(=O)NC(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)NS(=O)(=O)C3CC3)OC4=NC=CC5=C4C=CC(=C5)OC)C(C)(C)C

InChI

InChI=1S/C32H41N5O8S/c1-7-20-16-32(20,30(41)36-46(42,43)23-9-10-23)35-27(39)25-15-22(17-37(25)29(40)26(31(3,4)5)34-18(2)38)45-28-24-11-8-21(44-6)14-19(24)12-13-33-28/h7-8,11-14,20,22-23,25-26H,1,9-10,15-17H2,2-6H3,(H,34,38)(H,35,39)(H,36,41)