[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[1-(phenylsulfonyl)piperidin-3-yl]methanone

Systemtic Name: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-[1-(phenylsulfonyl)piperidin-3-yl]methanone Openeye Name: [1-(benzenesulfonyl)-3-piperidyl]-[4-(m-tolylmethyl)piperazin-1-yl]methanone CAS Name: [1-(benzenesulfonyl)-3-piperidinyl]-[4-[(3-methylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: [1-(benzenesulfonyl)piperidin-3-yl]-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (1-besyl-3-piperidyl)-[4-(3-methylbenzyl)piperazino]methanone Formula: C24H31N3O3S MolecularWeight: 441.58624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

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