[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methanone Openeye Name: [4-[(3-methyl-1-piperidyl)methyl]phenyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[4-[(3-methyl-1-piperidinyl)methyl]phenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methanone Traditional Name: [4-[(3-methylpiperidino)methyl]phenyl]-(4-tosylpiperazino)methanone Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1CCCN(C1)CC2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H33N3O3S/c1-20-5-11-24(12-6-20)32(30,31)28-16-14-27(15-17-28)25(29)23-9-7-22(8-10-23)19-26-13-3-4-21(2)18-26/h5-12,21H,3-4,13-19H2,1-2H3