ethyl 5-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-(4-oxo-2-thioxo-1H-quinazolin-3-yl)benzothiophene-2-carboxylate CAS Name: 5-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-1-benzothiophene-2-carboxylate Traditional Name: 5-(4-keto-2-thioxo-1H-quinazolin-3-yl)benzothiophene-2-carboxylic acid ethyl ester Formula: C19H14N2O3S2 MolecularWeight: 382.45606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)N3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)N3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C19H14N2O3S2/c1-2-24-18(23)16-10-11-9-12(7-8-15(11)26-16)21-17(22)13-5-3-4-6-14(13)20-19(21)25/h3-10H,2H2,1H3,(H,20,25)