dimethyl 2-[6-methoxy-2,2-dimethyl-1-(2-propylpentanoyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[6-methoxy-2,2-dimethyl-1-(2-propylpentanoyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[6-methoxy-2,2-dimethyl-1-(2-propylpentanoyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[6-methoxy-2,2-dimethyl-1-(1-oxo-2-propylpentyl)-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[6-methoxy-2,2-dimethyl-1-(2-propylpentanoyl)-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[6-methoxy-2,2-dimethyl-1-(2-propylpentanoyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C27H33NO6S3 MolecularWeight: 563.74902

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)N1C2=C(C=C(C=C2)OC)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C

Isomeric SMILES

CCCC(CCC)C(=O)N1C2=C(C=C(C=C2)OC)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C

InChI

InChI=1S/C27H33NO6S3/c1-8-10-15(11-9-2)23(29)28-18-13-12-16(32-5)14-17(18)19(22(35)27(28,3)4)26-36-20(24(30)33-6)21(37-26)25(31)34-7/h12-15H,8-11H2,1-7H3