3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methylphenyl)-1-(phenylsulfonyl)pyrrolidin-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methylphenyl)-1-(phenylsulfonyl)pyrrolidin-3-yl]methanone Openeye Name: [1-(benzenesulfonyl)-4-(p-tolyl)pyrrolidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-(benzenesulfonyl)-4-(4-methylphenyl)-3-pyrrolidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-(benzenesulfonyl)-4-(4-methylphenyl)pyrrolidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-besyl-4-(p-tolyl)pyrrolidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC2C(=O)N3CCC4=CC=CC=C4C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC2C(=O)N3CCC4=CC=CC=C4C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H28N2O3S/c1-20-11-13-22(14-12-20)25-18-29(33(31,32)24-9-3-2-4-10-24)19-26(25)27(30)28-16-15-21-7-5-6-8-23(21)17-28/h2-14,25-26H,15-19H2,1H3