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

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(m-tolylmethylsulfonyl)-4-piperidyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(3-methylphenyl)methylsulfonyl]-4-piperidinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-methylbenzyl)sulfonyl-4-piperidyl]methanone Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H28N2O3S/c1-18-5-4-6-19(15-18)17-29(27,28)25-13-10-21(11-14-25)23(26)24-12-9-20-7-2-3-8-22(20)16-24/h2-8,15,21H,9-14,16-17H2,1H3