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

Systemtic Name: ethyl 2-(1-hexanoyl-6-methoxy-2,2-dimethyl-3-sulfanylidene-quinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Openeye Name: ethyl 2-(1-hexanoyl-6-methoxy-2,2-dimethyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylate CAS Name: 2-[6-methoxy-2,2-dimethyl-1-(1-oxohexyl)-3-sulfanylidene-4-quinolinylidene]-5-phenyl-1,3-dithiole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(1-hexanoyl-6-methoxy-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Traditional Name: 2-(1-caproyl-6-methoxy-2,2-dimethyl-3-thioxo-4-quinolylidene)-5-phenyl-1,3-dithiole-4-carboxylic acid ethyl ester Formula: C30H33NO4S3 MolecularWeight: 567.78232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=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

CCCCCC(=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/C30H33NO4S3/c1-6-8-10-15-23(32)31-22-17-16-20(34-5)18-21(22)24(27(36)30(31,3)4)29-37-25(19-13-11-9-12-14-19)26(38-29)28(33)35-7-2/h9,11-14,16-18H,6-8,10,15H2,1-5H3