[1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(4-methoxy-3-methyl-phenyl)sulfonyl-4-piperidyl]methanone CAS Name: [1-(4-methoxy-3-methylphenyl)sulfonyl-4-piperidinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-(4-methoxy-3-methylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(4-methoxy-3-methyl-phenyl)sulfonyl-4-piperidyl]methanone Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O4S/c1-20-18-23(8-9-24(20)32-2)33(30,31)28-12-10-22(11-13-28)25(29)27-16-14-26(15-17-27)19-21-6-4-3-5-7-21/h3-9,18,22H,10-17,19H2,1-2H3