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

Systemtic Name: methyl 2-[[(2R)-oxan-2-yl]methylsulfanyl]-4-oxidanylidene-3-[(2R)-2-oxidanylpropyl]quinazoline-7-carboxylate Openeye Name: methyl 3-[(2R)-2-hydroxypropyl]-4-oxo-2-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]quinazoline-7-carboxylate CAS Name: 3-[(2R)-2-hydroxypropyl]-2-[[(2R)-2-oxanyl]methylthio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2R)-2-hydroxypropyl]-2-[[(2R)-oxan-2-yl]methylsulfanyl]-4-oxoquinazoline-7-carboxylate Traditional Name: 3-[(2R)-2-hydroxypropyl]-4-keto-2-[[(2R)-tetrahydropyran-2-yl]methylthio]quinazoline-7-carboxylic acid methyl ester Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC3CCCCO3)O

Isomeric SMILES

C[C@H](CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC[C@H]3CCCCO3)O

InChI

InChI=1S/C19H24N2O5S/c1-12(22)10-21-17(23)15-7-6-13(18(24)25-2)9-16(15)20-19(21)27-11-14-5-3-4-8-26-14/h6-7,9,12,14,22H,3-5,8,10-11H2,1-2H3/t12-,14-/m1/s1