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

Systemtic Name: methyl 2-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-3-isobutyl-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[(4R)-1,3-dioxan-4-yl]methylthio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[[(4R)-1,3-dioxan-4-yl]methylthio]-3-isobutyl-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C19H24N2O5S MolecularWeight: 392.46926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC3CCOCO3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC[C@H]3CCOCO3

InChI

InChI=1S/C19H24N2O5S/c1-12(2)9-21-17(22)15-5-4-13(18(23)24-3)8-16(15)20-19(21)27-10-14-6-7-25-11-26-14/h4-5,8,12,14H,6-7,9-11H2,1-3H3/t14-/m1/s1