N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: 2-(4-nosylpiperazino)-N-piazthiol-4-yl-acetamide Formula: C18H18N6O5S2 MolecularWeight: 462.50272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O5S2/c25-17(19-15-2-1-3-16-18(15)21-30-20-16)12-22-8-10-23(11-9-22)31(28,29)14-6-4-13(5-7-14)24(26)27/h1-7H,8-12H2,(H,19,25)