methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-isobutyl-2-[(5-methylisoxazol-3-yl)methylsulfanyl]-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-isobutyl-4-keto-2-[(5-methylisoxazol-3-yl)methylthio]quinazoline-7-carboxylic acid methyl ester Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC(C)C

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC(C)C

InChI

InChI=1S/C19H21N3O4S/c1-11(2)9-22-17(23)15-6-5-13(18(24)25-4)8-16(15)20-19(22)27-10-14-7-12(3)26-21-14/h5-8,11H,9-10H2,1-4H3