ethyl 2-(furan-2-yl)-4-methyl-6-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(furan-2-yl)-4-methyl-6-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 2-(2-furyl)-4-methyl-6-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carboxylate CAS Name: 2-(2-furanyl)-4-methyl-6-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(furan-2-yl)-4-methyl-6-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 2-(2-furyl)-4-[(4-keto-8-methyl-1H-quinazolin-2-yl)methylthio]-6-methyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1SCC2=NC(=O)C3=C(N2)C(=CC=C3)C)C4=CC=CO4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1SCC2=NC(=O)C3=C(N2)C(=CC=C3)C)C4=CC=CO4)C

InChI

InChI=1S/C22H20N4O4S/c1-4-29-22(28)17-13(3)23-19(15-9-6-10-30-15)26-21(17)31-11-16-24-18-12(2)7-5-8-14(18)20(27)25-16/h5-10H,4,11H2,1-3H3,(H,24,25,27)