ethyl 3-methyl-5-[[2-(4-methylphenyl)quinolin-4-yl]carbonylcarbamothioylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[[2-(4-methylphenyl)quinolin-4-yl]carbonylcarbamothioylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[2-(p-tolyl)quinoline-4-carbonyl]carbamothioylamino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[[[[2-(4-methylphenyl)-4-quinolinyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[[2-(4-methylphenyl)quinoline-4-carbonyl]carbamothioylamino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[2-(p-tolyl)quinoline-4-carbonyl]thiocarbamoylamino]thiophene-2-carboxylic acid ethyl ester Formula: C26H23N3O3S2 MolecularWeight: 489.60912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C26H23N3O3S2/c1-4-32-25(31)23-16(3)13-22(34-23)28-26(33)29-24(30)19-14-21(17-11-9-15(2)10-12-17)27-20-8-6-5-7-18(19)20/h5-14H,4H2,1-3H3,(H2,28,29,30,33)