ethyl 5-ethanoyl-4-methyl-2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-(4-oxo-2-thioxo-1H-quinazolin-3-yl)thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)thiophene-3-carboxylate Traditional Name: 5-acetyl-2-(4-keto-2-thioxo-1H-quinazolin-3-yl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H16N2O4S2 MolecularWeight: 388.46064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)N2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)N2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C18H16N2O4S2/c1-4-24-17(23)13-9(2)14(10(3)21)26-16(13)20-15(22)11-7-5-6-8-12(11)19-18(20)25/h5-8H,4H2,1-3H3,(H,19,25)