diethyl 3-methyl-5-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)carbothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)carbothioylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(6-methyl-3,4-dihydro-2H-quinoline-1-carbothioyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(6-methyl-3,4-dihydro-2H-quinoline-1-carbothioyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(6-methyl-3,4-dihydro-2H-quinoline-1-carbothioyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCCC3=C2C=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCCC3=C2C=CC(=C3)C

InChI

InChI=1S/C22H26N2O4S2/c1-5-27-20(25)17-14(4)18(21(26)28-6-2)30-19(17)23-22(29)24-11-7-8-15-12-13(3)9-10-16(15)24/h9-10,12H,5-8,11H2,1-4H3,(H,23,29)