[1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(m-tolylmethylsulfonyl)-4-piperidyl]methanone CAS Name: [1-[(3-methylphenyl)methylsulfonyl]-4-piperidinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(3-methylbenzyl)sulfonyl-4-piperidyl]methanone Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O3S/c1-21-6-5-9-23(18-21)20-32(30,31)28-12-10-24(11-13-28)25(29)27-16-14-26(15-17-27)19-22-7-3-2-4-8-22/h2-9,18,24H,10-17,19-20H2,1H3