(2Z)-6-ethanoyl-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N-[[(4-nitrophenyl)amino]carbamothioyl]-1H-quinoline-4-carboxamide

Systemtic Name: (2Z)-6-ethanoyl-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N-[[(4-nitrophenyl)amino]carbamothioyl]-1H-quinoline-4-carboxamide Openeye Name: (2Z)-6-acetyl-2-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N-[(4-nitroanilino)carbamothioyl]-1H-quinoline-4-carboxamide CAS Name: (2Z)-6-acetyl-2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-N-[[(4-nitrophenyl)hydrazo]-sulfanylidenemethyl]-1H-quinoline-4-carboxamide IUPAC Name: (2Z)-6-acetyl-2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-N-[(4-nitroanilino)carbamothioyl]-1H-quinoline-4-carboxamide Traditional Name: (2Z)-6-acetyl-2-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-N-[(4-nitroanilino)thiocarbamoyl]-1H-quinoline-4-carboxamide Formula: C26H21N5O6S MolecularWeight: 531.53984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)NC(=C3C=CC(=O)C(=C3)OC)C=C2C(=O)NC(=S)NNC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N/C(=C\3/C=CC(=O)C(=C3)OC)/C=C2C(=O)NC(=S)NNC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H21N5O6S/c1-14(32)15-3-9-21-19(11-15)20(13-22(27-21)16-4-10-23(33)24(12-16)37-2)25(34)28-26(38)30-29-17-5-7-18(8-6-17)31(35)36/h3-13,27,29H,1-2H3,(H2,28,30,34,38)/b22-16-