2-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C15H20N6O5S2 MolecularWeight: 428.4865

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H20N6O5S2/c1-17-10-16-20(15(17)27)11-18-5-7-19(8-6-18)28(24,25)12-3-4-14(26-2)13(9-12)21(22)23/h3-4,9-10H,5-8,11H2,1-2H3