methyl 3-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 3-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 3-indan-5-yl-4-oxo-2-thioxo-1H-quinazoline-7-carboxylate CAS Name: 3-(2,3-dihydro-1H-inden-5-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 3-(2,3-dihydro-1H-inden-5-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate Traditional Name: 3-indan-5-yl-4-keto-2-thioxo-1H-quinazoline-7-carboxylic acid methyl ester Formula: C19H16N2O3S MolecularWeight: 352.40694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C19H16N2O3S/c1-24-18(23)13-6-8-15-16(10-13)20-19(25)21(17(15)22)14-7-5-11-3-2-4-12(11)9-14/h5-10H,2-4H2,1H3,(H,20,25)