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

Systemtic Name: methyl 4-oxidanylidene-3-[(2R)-2-oxidanylpropyl]-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazoline-7-carboxylate Openeye Name: methyl 3-[(2R)-2-hydroxypropyl]-4-oxo-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]quinazoline-7-carboxylate CAS Name: 3-[(2R)-2-hydroxypropyl]-4-oxo-2-[[(2R)-2-oxolanyl]methylthio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2R)-2-hydroxypropyl]-4-oxo-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazoline-7-carboxylate Traditional Name: 3-[(2R)-2-hydroxypropyl]-4-keto-2-[[(2R)-tetrahydrofuran-2-yl]methylthio]quinazoline-7-carboxylic acid methyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC3CCCO3)O

Isomeric SMILES

C[C@H](CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC[C@H]3CCCO3)O

InChI

InChI=1S/C18H22N2O5S/c1-11(21)9-20-16(22)14-6-5-12(17(23)24-2)8-15(14)19-18(20)26-10-13-4-3-7-25-13/h5-6,8,11,13,21H,3-4,7,9-10H2,1-2H3/t11-,13-/m1/s1