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

Systemtic Name: (2Z)-6-ethanoyl-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N-[(3-methoxyphenyl)carbamothioyl]-1H-quinoline-4-carboxamide Openeye Name: (2Z)-6-acetyl-2-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N-[(3-methoxyphenyl)carbamothioyl]-1H-quinoline-4-carboxamide CAS Name: (2Z)-6-acetyl-N-[(3-methoxyanilino)-sulfanylidenemethyl]-2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1H-quinoline-4-carboxamide IUPAC Name: (2Z)-6-acetyl-2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-N-[(3-methoxyphenyl)carbamothioyl]-1H-quinoline-4-carboxamide Traditional Name: (2Z)-6-acetyl-2-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-N-[(3-methoxyphenyl)thiocarbamoyl]-1H-quinoline-4-carboxamide Formula: C27H23N3O5S MolecularWeight: 501.55362

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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)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N/C(=C\3/C=CC(=O)C(=C3)OC)/C=C2C(=O)NC(=S)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C27H23N3O5S/c1-15(31)16-7-9-22-20(11-16)21(14-23(29-22)17-8-10-24(32)25(12-17)35-3)26(33)30-27(36)28-18-5-4-6-19(13-18)34-2/h4-14,29H,1-3H3,(H2,28,30,33,36)/b23-17-