N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-[4-(2,5-dimethylphenyl)-1-piperazinyl]-2-oxoethyl]-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-[4-(2,5-dimethylphenyl)piperazino]-2-keto-ethyl]-N-methyl-piazthiole-4-sulfonamide Formula: C21H25N5O3S2 MolecularWeight: 459.5849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CN(C)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CN(C)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H25N5O3S2/c1-15-7-8-16(2)18(13-15)25-9-11-26(12-10-25)20(27)14-24(3)31(28,29)19-6-4-5-17-21(19)23-30-22-17/h4-8,13H,9-12,14H2,1-3H3