N-[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-[3-methyl-4-(p-tolyl)piperazin-1-yl]-2-oxo-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-[3-methyl-4-(4-methylphenyl)-1-piperazinyl]-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-keto-2-[3-methyl-4-(p-tolyl)piperazino]-1-phenyl-ethyl]piazthiole-4-sulfonamide Formula: C26H27N5O3S2 MolecularWeight: 521.65428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C26H27N5O3S2/c1-18-11-13-21(14-12-18)31-16-15-30(17-19(31)2)26(32)24(20-7-4-3-5-8-20)29-36(33,34)23-10-6-9-22-25(23)28-35-27-22/h3-14,19,24,29H,15-17H2,1-2H3