ethyl 2-(6-methoxy-2,2-dimethyl-1-propanoyl-3-sulfanylidene-quinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate

Systemtic Name: ethyl 2-(6-methoxy-2,2-dimethyl-1-propanoyl-3-sulfanylidene-quinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Openeye Name: ethyl 2-(6-methoxy-2,2-dimethyl-1-propanoyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylate CAS Name: 2-[6-methoxy-2,2-dimethyl-1-(1-oxopropyl)-3-sulfanylidene-4-quinolinylidene]-5-phenyl-1,3-dithiole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(6-methoxy-2,2-dimethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Traditional Name: 2-(6-methoxy-2,2-dimethyl-1-propionyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylic acid ethyl ester Formula: C27H27NO4S3 MolecularWeight: 525.70258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C2=C(C=C(C=C2)OC)C(=C3SC(=C(S3)C(=O)OCC)C4=CC=CC=C4)C(=S)C1(C)C

Isomeric SMILES

CCC(=O)N1C2=C(C=C(C=C2)OC)C(=C3SC(=C(S3)C(=O)OCC)C4=CC=CC=C4)C(=S)C1(C)C

InChI

InChI=1S/C27H27NO4S3/c1-6-20(29)28-19-14-13-17(31-5)15-18(19)21(24(33)27(28,3)4)26-34-22(16-11-9-8-10-12-16)23(35-26)25(30)32-7-2/h8-15H,6-7H2,1-5H3