N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methylideneamino]pyridine-4-carboxamide Openeye Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methyleneamino]pyridine-4-carboxamide CAS Name: N-[(E)-[4-[(1-methyl-2-imidazolyl)thio]-3-nitrophenyl]methylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitrophenyl]methylideneamino]pyridine-4-carboxamide Traditional Name: N-[(E)-[4-[(1-methylimidazol-2-yl)thio]-3-nitro-benzylidene]amino]isonicotinamide Formula: C17H14N6O3S MolecularWeight: 382.39646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2)C=NNC(=O)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O3S/c1-22-9-8-19-17(22)27-15-3-2-12(10-14(15)23(25)26)11-20-21-16(24)13-4-6-18-7-5-13/h2-11H,1H3,(H,21,24)/b20-11+