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

Systemtic Name: methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazoline-7-carboxylate Openeye Name: methyl 2-[(5-methylisoxazol-3-yl)methylsulfanyl]-4-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxylate CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-4-oxo-3-[[(2R)-2-oxolanyl]methyl]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-4-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazoline-7-carboxylate Traditional Name: 4-keto-2-[(5-methylisoxazol-3-yl)methylthio]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxylic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4CCCO4

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2C[C@H]4CCCO4

InChI

InChI=1S/C20H21N3O5S/c1-12-8-14(22-28-12)11-29-20-21-17-9-13(19(25)26-2)5-6-16(17)18(24)23(20)10-15-4-3-7-27-15/h5-6,8-9,15H,3-4,7,10-11H2,1-2H3/t15-/m1/s1