(3R)-N-cyclopentyl-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-N-cyclopentyl-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-(benzenesulfonyl)-N-cyclopentyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-(benzenesulfonyl)-N-cyclopentyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-(benzenesulfonyl)-N-cyclopentyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-besyl-N-cyclopentyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)[C@H]2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H24N2O3S/c24-21(22-18-10-6-7-11-18)20-14-16-8-4-5-9-17(16)15-23(20)27(25,26)19-12-2-1-3-13-19/h1-5,8-9,12-13,18,20H,6-7,10-11,14-15H2,(H,22,24)/t20-/m1/s1