N-ethyl-4-methyl-3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-ethyl-4-methyl-3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-ethyl-4-methyl-3-[4-(m-tolylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-ethyl-4-methyl-3-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-ethyl-4-methyl-3-[4-[(3-methylphenyl)methyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-ethyl-4-methyl-3-[4-(3-methylbenzyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC3=CC=CC(=C3)C

Isomeric SMILES

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC3=CC=CC(=C3)C

InChI

InChI=1S/C22H29N3O3S/c1-4-23-29(27,28)20-9-8-18(3)21(15-20)22(26)25-12-10-24(11-13-25)16-19-7-5-6-17(2)14-19/h5-9,14-15,23H,4,10-13,16H2,1-3H3