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

Systemtic Name: methyl 5-phenyl-2-[2,2,6,7-tetramethyl-1-(2-phenylethanoyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4-carboxylate Openeye Name: methyl 5-phenyl-2-[2,2,6,7-tetramethyl-1-(2-phenylacetyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4-carboxylate CAS Name: 5-phenyl-2-[2,2,6,7-tetramethyl-1-(1-oxo-2-phenylethyl)-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-phenyl-2-[2,2,6,7-tetramethyl-1-(2-phenylacetyl)-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4-carboxylate Traditional Name: 5-phenyl-2-[2,2,6,7-tetramethyl-1-(2-phenylacetyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4-carboxylic acid methyl ester Formula: C32H29NO3S3 MolecularWeight: 571.77256

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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)CC5=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)CC5=CC=CC=C5)(C)C)C

InChI

InChI=1S/C32H29NO3S3/c1-19-16-23-24(17-20(19)2)33(25(34)18-21-12-8-6-9-13-21)32(3,4)29(37)26(23)31-38-27(22-14-10-7-11-15-22)28(39-31)30(35)36-5/h6-17H,18H2,1-5H3