(4Z)-2-methoxy-6-nitro-4-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-2-methoxy-6-nitro-4-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-2-methoxy-6-nitro-4-[[(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: (4Z)-2-methoxy-6-nitro-4-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-2-methoxy-6-nitro-4-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-2-methoxy-6-nitro-4-[[(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C16H13N5O4S MolecularWeight: 371.37052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNN2C(=NNC2=S)C3=CC=CC=C3)C=C(C1=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C/C(=C\NN2C(=NNC2=S)C3=CC=CC=C3)/C=C(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O4S/c1-25-13-8-10(7-12(14(13)22)21(23)24)9-17-20-15(18-19-16(20)26)11-5-3-2-4-6-11/h2-9,17H,1H3,(H,19,26)/b10-9-