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

Systemtic Name: N-(2,3-dimethylphenyl)-4-(4-methylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(2,3-dimethylphenyl)-4-(4-methylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(2,3-dimethylphenyl)-4-[(4-methyl-1-piperazinyl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(2,3-dimethylphenyl)-4-(4-methylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-(2,3-dimethylphenyl)-4-(4-methylpiperazine-1-carbonyl)benzenesulfonamide Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O3S/c1-15-5-4-6-19(16(15)2)21-27(25,26)18-9-7-17(8-10-18)20(24)23-13-11-22(3)12-14-23/h4-10,21H,11-14H2,1-3H3