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

Systemtic Name: 1-(2-azanyl-3,3-dimethyl-butanoyl)-N-[1-(cyclobutylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-4-(6-methoxyisoquinolin-1-yl)oxy-pyrrolidine-2-carboxamide Openeye Name: 1-(2-amino-3,3-dimethyl-butanoyl)-N-[1-(cyclobutylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-[(6-methoxy-1-isoquinolyl)oxy]pyrrolidine-2-carboxamide CAS Name: 1-(2-amino-3,3-dimethyl-1-oxobutyl)-N-[1-[(cyclobutylsulfonylamino)-oxomethyl]-2-ethenylcyclopropyl]-4-[(6-methoxy-1-isoquinolinyl)oxy]-2-pyrrolidinecarboxamide IUPAC Name: 1-(2-amino-3,3-dimethylbutanoyl)-N-[1-(cyclobutylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-4-(6-methoxyisoquinolin-1-yl)oxypyrrolidine-2-carboxamide Traditional Name: 1-(2-amino-3,3-dimethyl-butanoyl)-N-[1-(cyclobutylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-[(6-methoxy-1-isoquinolyl)oxy]pyrrolidine-2-carboxamide Formula: C31H41N5O7S MolecularWeight: 627.75154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)NS(=O)(=O)C3CCC3)OC4=NC=CC5=C4C=CC(=C5)OC)N

Isomeric SMILES

CC(C)(C)C(C(=O)N1CC(CC1C(=O)NC2(CC2C=C)C(=O)NS(=O)(=O)C3CCC3)OC4=NC=CC5=C4C=CC(=C5)OC)N

InChI

InChI=1S/C31H41N5O7S/c1-6-19-16-31(19,29(39)35-44(40,41)22-8-7-9-22)34-26(37)24-15-21(17-36(24)28(38)25(32)30(2,3)4)43-27-23-11-10-20(42-5)14-18(23)12-13-33-27/h6,10-14,19,21-22,24-25H,1,7-9,15-17,32H2,2-5H3,(H,34,37)(H,35,39)