dimethyl 2-(7-methoxy-2,2-dimethyl-1-pentanoyl-3-sulfanylidene-quinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(7-methoxy-2,2-dimethyl-1-pentanoyl-3-sulfanylidene-quinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(7-methoxy-2,2-dimethyl-1-pentanoyl-3-thioxo-4-quinolylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[7-methoxy-2,2-dimethyl-1-(1-oxopentyl)-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(7-methoxy-2,2-dimethyl-1-pentanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(7-methoxy-2,2-dimethyl-3-thioxo-1-valeryl-4-quinolylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C24H27NO6S3 MolecularWeight: 521.66928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C2=C(C=CC(=C2)OC)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C

Isomeric SMILES

CCCCC(=O)N1C2=C(C=CC(=C2)OC)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C

InChI

InChI=1S/C24H27NO6S3/c1-7-8-9-16(26)25-15-12-13(29-4)10-11-14(15)17(20(32)24(25,2)3)23-33-18(21(27)30-5)19(34-23)22(28)31-6/h10-12H,7-9H2,1-6H3