4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-[[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-[4-(3,4-dimethylphenyl)sulfonylpiperazino]sulfonylpiazthiole Formula: C18H20N4O4S3 MolecularWeight: 452.5708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O4S3/c1-13-6-7-15(12-14(13)2)28(23,24)21-8-10-22(11-9-21)29(25,26)17-5-3-4-16-18(17)20-27-19-16/h3-7,12H,8-11H2,1-2H3