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

Systemtic Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methylideneamino]pyridine-3-carboxamide Openeye Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methyleneamino]pyridine-3-carboxamide CAS Name: N-[(E)-[4-[(1-methyl-2-imidazolyl)thio]-3-nitrophenyl]methylideneamino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitrophenyl]methylideneamino]pyridine-3-carboxamide Traditional Name: N-[(E)-[4-[(1-methylimidazol-2-yl)thio]-3-nitro-benzylidene]amino]nicotinamide 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=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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