3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyrrolidin-1-ylphenyl)benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyrrolidin-1-ylphenyl)benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyrrolidin-1-ylphenyl)benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyrrolidin-1-ylphenyl)benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyrrolidinophenyl)benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H27N3O3S/c30-26(27-24-12-3-4-13-25(24)28-15-5-6-16-28)21-10-7-11-23(18-21)33(31,32)29-17-14-20-8-1-2-9-22(20)19-29/h1-4,7-13,18H,5-6,14-17,19H2,(H,27,30)