diethyl 2-[1-(4-tert-butylphenyl)carbonyl-6-methoxy-2,2-dimethyl-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: diethyl 2-[1-(4-tert-butylphenyl)carbonyl-6-methoxy-2,2-dimethyl-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: diethyl 2-[1-(4-tert-butylbenzoyl)-6-methoxy-2,2-dimethyl-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[1-[(4-tert-butylphenyl)-oxomethyl]-6-methoxy-2,2-dimethyl-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[1-(4-tert-butylbenzoyl)-6-methoxy-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[1-(4-tert-butylbenzoyl)-6-methoxy-2,2-dimethyl-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylic acid diethyl ester Formula: C32H35NO6S3 MolecularWeight: 625.8184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C2C3=C(C=CC(=C3)OC)N(C(C2=S)(C)C)C(=O)C4=CC=C(C=C4)C(C)(C)C)S1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C2C3=C(C=CC(=C3)OC)N(C(C2=S)(C)C)C(=O)C4=CC=C(C=C4)C(C)(C)C)S1)C(=O)OCC

InChI

InChI=1S/C32H35NO6S3/c1-9-38-28(35)24-25(29(36)39-10-2)42-30(41-24)23-21-17-20(37-8)15-16-22(21)33(32(6,7)26(23)40)27(34)18-11-13-19(14-12-18)31(3,4)5/h11-17H,9-10H2,1-8H3