2-cyclopentyl-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide

Systemtic Name: 2-cyclopentyl-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-cyclopentyl-acetamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-cyclopentylacetamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-cyclopentylacetamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-cyclopentyl-acetamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

C1CCC(C1)CC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C22H26N2O3S/c25-22(14-17-6-4-5-7-17)23-20-11-10-18-12-13-24(16-19(18)15-20)28(26,27)21-8-2-1-3-9-21/h1-3,8-11,15,17H,4-7,12-14,16H2,(H,23,25)