dimethyl 2-[6-chloranyl-2,2-dimethyl-1-[(4-methylphenyl)carbamoyl]-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[6-chloranyl-2,2-dimethyl-1-[(4-methylphenyl)carbamoyl]-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[6-chloro-2,2-dimethyl-1-(p-tolylcarbamoyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[6-chloro-2,2-dimethyl-1-[(4-methylanilino)-oxomethyl]-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[6-chloro-2,2-dimethyl-1-[(4-methylphenyl)carbamoyl]-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[6-chloro-2,2-dimethyl-1-(p-tolylcarbamoyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C26H23ClN2O5S3 MolecularWeight: 575.11922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2C3=C(C=C(C=C3)Cl)C(=C4SC(=C(S4)C(=O)OC)C(=O)OC)C(=S)C2(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2C3=C(C=C(C=C3)Cl)C(=C4SC(=C(S4)C(=O)OC)C(=O)OC)C(=S)C2(C)C

InChI

InChI=1S/C26H23ClN2O5S3/c1-13-6-9-15(10-7-13)28-25(32)29-17-11-8-14(27)12-16(17)18(21(35)26(29,2)3)24-36-19(22(30)33-4)20(37-24)23(31)34-5/h6-12H,1-5H3,(H,28,32)