2-(5-nitrothiophen-2-yl)-N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]quinoline-4-carbohydrazide

Systemtic Name: 2-(5-nitrothiophen-2-yl)-N'-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]quinoline-4-carbohydrazide Openeye Name: 2-(5-nitro-2-thienyl)-N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]quinoline-4-carbohydrazide CAS Name: 2-(5-nitro-2-thiophenyl)-N'-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-quinolinecarbohydrazide IUPAC Name: 2-(5-nitrothiophen-2-yl)-N'-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]quinoline-4-carbohydrazide Traditional Name: N'-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2-(5-nitro-2-thienyl)cinchoninohydrazide Formula: C21H14N4O4S MolecularWeight: 418.42526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)[N+](=O)[O-])C(=O)NNC=C4C=CC(=O)C=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)[N+](=O)[O-])C(=O)NNC=C4C=CC(=O)C=C4

InChI

InChI=1S/C21H14N4O4S/c26-14-7-5-13(6-8-14)12-22-24-21(27)16-11-18(19-9-10-20(30-19)25(28)29)23-17-4-2-1-3-15(16)17/h1-12,22H,(H,24,27)