4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(2-ketopyrrolidino)-3-methyl-phenyl]benzamide Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)N5CCCC5=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)N5CCCC5=O

InChI

InChI=1S/C27H27N3O4S/c1-19-17-23(10-13-25(19)30-15-4-7-26(30)31)28-27(32)21-8-11-24(12-9-21)35(33,34)29-16-14-20-5-2-3-6-22(20)18-29/h2-3,5-6,8-13,17H,4,7,14-16,18H2,1H3,(H,28,32)