methyl 2-[7-ethoxy-2,2-dimethyl-1-(phenylcarbonyl)-3-sulfanylidene-quinolin-4-ylidene]-5-phenyl-1,3-dithiole-4-carboxylate

Systemtic Name: methyl 2-[7-ethoxy-2,2-dimethyl-1-(phenylcarbonyl)-3-sulfanylidene-quinolin-4-ylidene]-5-phenyl-1,3-dithiole-4-carboxylate Openeye Name: methyl 2-(1-benzoyl-7-ethoxy-2,2-dimethyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylate CAS Name: 2-(1-benzoyl-7-ethoxy-2,2-dimethyl-3-sulfanylidene-4-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-(1-benzoyl-7-ethoxy-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Traditional Name: 2-(1-benzoyl-7-ethoxy-2,2-dimethyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylic acid methyl ester Formula: C31H27NO4S3 MolecularWeight: 573.74538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(=C3SC(=C(S3)C(=O)OC)C4=CC=CC=C4)C(=S)C(N2C(=O)C5=CC=CC=C5)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(=C3SC(=C(S3)C(=O)OC)C4=CC=CC=C4)C(=S)C(N2C(=O)C5=CC=CC=C5)(C)C

InChI

InChI=1S/C31H27NO4S3/c1-5-36-21-16-17-22-23(18-21)32(28(33)20-14-10-7-11-15-20)31(2,3)27(37)24(22)30-38-25(19-12-8-6-9-13-19)26(39-30)29(34)35-4/h6-18H,5H2,1-4H3