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

Systemtic Name: [1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-(m-tolylmethylsulfonyl)-4-piperidyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [1-[(3-methylphenyl)methylsulfonyl]-4-piperidinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-(3-methylbenzyl)sulfonyl-4-piperidyl]-(4-phenylpiperazino)methanone Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O3S/c1-20-6-5-7-21(18-20)19-31(29,30)27-12-10-22(11-13-27)24(28)26-16-14-25(15-17-26)23-8-3-2-4-9-23/h2-9,18,22H,10-17,19H2,1H3