N-(2-methoxy-5-nitro-phenyl)-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H14N6O6S MolecularWeight: 430.39466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NNC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NNC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O6S/c1-29-14-6-5-12(23(27)28)8-13(14)18-15(24)9-30-17-19-16(20-21-17)10-3-2-4-11(7-10)22(25)26/h2-8H,9H2,1H3,(H,18,24)(H,19,20,21)