3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5

InChI

InChI=1S/C27H29N3O3S/c31-27(28-25-14-15-29(20-25)18-21-7-2-1-3-8-21)23-11-6-12-26(17-23)34(32,33)30-16-13-22-9-4-5-10-24(22)19-30/h1-12,17,25H,13-16,18-20H2,(H,28,31)