N-[4-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]benzenesulfonamide

Systemtic Name: N-[4-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]benzenesulfonamide Openeye Name: N-[4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]thiazol-2-yl]benzenesulfonamide CAS Name: N-[4-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2-thiazolyl]benzenesulfonamide IUPAC Name: N-[4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl]benzenesulfonamide Traditional Name: N-[4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]thiazol-2-yl]benzenesulfonamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CSC(=N3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CSC(=N3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S2/c1-16-8-9-17(2)20(14-16)25-10-12-26(13-11-25)21(27)19-15-30-22(23-19)24-31(28,29)18-6-4-3-5-7-18/h3-9,14-15H,10-13H2,1-2H3,(H,23,24)