methyl 2-(2-methylsulfanyl-6-pyridin-3-ylcarbonyl-4H-quinazolin-3-yl)ethanoate

Systemtic Name: methyl 2-(2-methylsulfanyl-6-pyridin-3-ylcarbonyl-4H-quinazolin-3-yl)ethanoate Openeye Name: methyl 2-[2-methylsulfanyl-6-(pyridine-3-carbonyl)-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-(methylthio)-6-[oxo(3-pyridinyl)methyl]-4H-quinazolin-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-methylsulfanyl-6-(pyridine-3-carbonyl)-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-(methylthio)-6-nicotinoyl-4H-quinazolin-3-yl]acetic acid methyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CC2=C(C=CC(=C2)C(=O)C3=CN=CC=C3)N=C1SC

Isomeric SMILES

COC(=O)CN1CC2=C(C=CC(=C2)C(=O)C3=CN=CC=C3)N=C1SC

InChI

InChI=1S/C18H17N3O3S/c1-24-16(22)11-21-10-14-8-12(5-6-15(14)20-18(21)25-2)17(23)13-4-3-7-19-9-13/h3-9H,10-11H2,1-2H3