4-methyl-N-[[(2R)-1-methyl-4-[(3-methylphenyl)methyl]-5-oxidanylidene-piperazin-2-yl]methyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[[(2R)-1-methyl-4-[(3-methylphenyl)methyl]-5-oxidanylidene-piperazin-2-yl]methyl]benzenesulfonamide Openeye Name: 4-methyl-N-[[(2R)-1-methyl-4-(m-tolylmethyl)-5-oxo-piperazin-2-yl]methyl]benzenesulfonamide CAS Name: 4-methyl-N-[[(2R)-1-methyl-4-[(3-methylphenyl)methyl]-5-oxo-2-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[[(2R)-1-methyl-4-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl]methyl]benzenesulfonamide Traditional Name: N-[[(2R)-5-keto-1-methyl-4-(3-methylbenzyl)piperazin-2-yl]methyl]-4-methyl-benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CN(C(=O)CN2C)CC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC[C@H]2CN(C(=O)CN2C)CC3=CC=CC(=C3)C

InChI

InChI=1S/C21H27N3O3S/c1-16-7-9-20(10-8-16)28(26,27)22-12-19-14-24(21(25)15-23(19)3)13-18-6-4-5-17(2)11-18/h4-11,19,22H,12-15H2,1-3H3/t19-/m0/s1