methyl 5-phenyl-2-[2,2,6,7-tetramethyl-1-(phenylcarbonyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4-carboxylate

Systemtic Name: methyl 5-phenyl-2-[2,2,6,7-tetramethyl-1-(phenylcarbonyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4-carboxylate Openeye Name: methyl 2-(1-benzoyl-2,2,6,7-tetramethyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylate CAS Name: 2-(1-benzoyl-2,2,6,7-tetramethyl-3-sulfanylidene-4-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-(1-benzoyl-2,2,6,7-tetramethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Traditional Name: 2-(1-benzoyl-2,2,6,7-tetramethyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylic acid methyl ester Formula: C31H27NO3S3 MolecularWeight: 557.74598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C3SC(=C(S3)C(=O)OC)C4=CC=CC=C4)C(=S)C(N2C(=O)C5=CC=CC=C5)(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C3SC(=C(S3)C(=O)OC)C4=CC=CC=C4)C(=S)C(N2C(=O)C5=CC=CC=C5)(C)C)C

InChI

InChI=1S/C31H27NO3S3/c1-18-16-22-23(17-19(18)2)32(28(33)21-14-10-7-11-15-21)31(3,4)27(36)24(22)30-37-25(20-12-8-6-9-13-20)26(38-30)29(34)35-5/h6-17H,1-5H3