2-(2-azanyl-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-4-isoquinolin-1-yloxy-cyclopentane-1-carboxamide

Systemtic Name: 2-(2-azanyl-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-4-isoquinolin-1-yloxy-cyclopentane-1-carboxamide Openeye Name: 2-(2-amino-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-(1-isoquinolyloxy)cyclopentanecarboxamide CAS Name: 2-(2-amino-3,3-dimethyl-1-oxobutyl)-N-[1-[(cyclopropylsulfonylamino)-oxomethyl]-2-ethenylcyclopropyl]-4-(1-isoquinolinyloxy)-1-cyclopentanecarboxamide IUPAC Name: 2-(2-amino-3,3-dimethylbutanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-4-isoquinolin-1-yloxycyclopentane-1-carboxamide Traditional Name: 2-(2-amino-3,3-dimethyl-butanoyl)-N-[1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-(1-isoquinolyloxy)cyclopentanecarboxamide Formula: C30H38N4O6S MolecularWeight: 582.71092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1CC(CC1C(=O)NC2(CC2C=C)C(=O)NS(=O)(=O)C3CC3)OC4=NC=CC5=CC=CC=C54)N

Isomeric SMILES

CC(C)(C)C(C(=O)C1CC(CC1C(=O)NC2(CC2C=C)C(=O)NS(=O)(=O)C3CC3)OC4=NC=CC5=CC=CC=C54)N

InChI

InChI=1S/C30H38N4O6S/c1-5-18-16-30(18,28(37)34-41(38,39)20-10-11-20)33-26(36)23-15-19(14-22(23)24(35)25(31)29(2,3)4)40-27-21-9-7-6-8-17(21)12-13-32-27/h5-9,12-13,18-20,22-23,25H,1,10-11,14-16,31H2,2-4H3,(H,33,36)(H,34,37)