(2Z)-6-ethanoyl-N-[[(2-methylphenyl)amino]carbamothioyl]-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinoline-4-carboxamide

Systemtic Name: (2Z)-6-ethanoyl-N-[[(2-methylphenyl)amino]carbamothioyl]-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinoline-4-carboxamide Openeye Name: (2Z)-6-acetyl-N-[(2-methylanilino)carbamothioyl]-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinoline-4-carboxamide CAS Name: (2Z)-6-acetyl-N-[[(2-methylphenyl)hydrazo]-sulfanylidenemethyl]-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinoline-4-carboxamide IUPAC Name: (2Z)-6-acetyl-N-[(2-methylanilino)carbamothioyl]-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinoline-4-carboxamide Traditional Name: (2Z)-6-acetyl-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-N-(o-toluidinothiocarbamoyl)-1H-quinoline-4-carboxamide Formula: C26H22N4O3S MolecularWeight: 470.54288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NNC(=S)NC(=O)C2=CC(=C3C=CC=CC3=O)NC4=C2C=C(C=C4)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1NNC(=S)NC(=O)C2=C/C(=C/3\C=CC=CC3=O)/NC4=C2C=C(C=C4)C(=O)C

InChI

InChI=1S/C26H22N4O3S/c1-15-7-3-5-9-21(15)29-30-26(34)28-25(33)20-14-23(18-8-4-6-10-24(18)32)27-22-12-11-17(16(2)31)13-19(20)22/h3-14,27,29H,1-2H3,(H2,28,30,33,34)/b23-18-