N-(2,3-dimethylphenyl)-2-methyl-5-(4-methylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-methyl-5-(4-methylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(2,3-dimethylphenyl)-2-methyl-5-(4-methylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(2,3-dimethylphenyl)-2-methyl-5-[(4-methyl-1-piperazinyl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(2,3-dimethylphenyl)-2-methyl-5-(4-methylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-(2,3-dimethylphenyl)-2-methyl-5-(4-methylpiperazine-1-carbonyl)benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C)C)C

InChI

InChI=1S/C21H27N3O3S/c1-15-6-5-7-19(17(15)3)22-28(26,27)20-14-18(9-8-16(20)2)21(25)24-12-10-23(4)11-13-24/h5-9,14,22H,10-13H2,1-4H3