N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-N-piazthiol-4-yl-acetamide Formula: C19H20N6O6S2 MolecularWeight: 492.5287

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC4=NSN=C43)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC4=NSN=C43)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O6S2/c1-31-17-6-5-13(11-16(17)25(27)28)33(29,30)24-9-7-23(8-10-24)12-18(26)20-14-3-2-4-15-19(14)22-32-21-15/h2-6,11H,7-10,12H2,1H3,(H,20,26)