methyl 3-(furan-2-ylmethyl)-4-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazoline-7-carboxylate

Systemtic Name: methyl 3-(furan-2-ylmethyl)-4-oxidanylidene-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazoline-7-carboxylate Openeye Name: methyl 3-(2-furylmethyl)-4-oxo-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]quinazoline-7-carboxylate CAS Name: 3-(2-furanylmethyl)-4-oxo-2-[[(2R)-2-oxolanyl]methylthio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(furan-2-ylmethyl)-4-oxo-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazoline-7-carboxylate Traditional Name: 3-(2-furfuryl)-4-keto-2-[[(2R)-tetrahydrofuran-2-yl]methylthio]quinazoline-7-carboxylic acid methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3CCCO3)CC4=CC=CO4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SC[C@H]3CCCO3)CC4=CC=CO4

InChI

InChI=1S/C20H20N2O5S/c1-25-19(24)13-6-7-16-17(10-13)21-20(28-12-15-5-3-9-27-15)22(18(16)23)11-14-4-2-8-26-14/h2,4,6-8,10,15H,3,5,9,11-12H2,1H3/t15-/m1/s1