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

Systemtic Name: [1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-[1-(m-tolylmethylsulfonyl)-4-piperidyl]methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[1-[(3-methylphenyl)methylsulfonyl]-4-piperidinyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-[1-[(3-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone Traditional Name: (4-besylpiperazino)-[1-(3-methylbenzyl)sulfonyl-4-piperidyl]methanone Formula: C24H31N3O5S2 MolecularWeight: 505.65004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O5S2/c1-20-6-5-7-21(18-20)19-33(29,30)26-12-10-22(11-13-26)24(28)25-14-16-27(17-15-25)34(31,32)23-8-3-2-4-9-23/h2-9,18,22H,10-17,19H2,1H3