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

Systemtic Name: methyl 2-(2-methylsulfanylethylsulfanyl)-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazoline-7-carboxylate Openeye Name: methyl 2-(2-methylsulfanylethylsulfanyl)-4-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxylate CAS Name: 2-[2-(methylthio)ethylthio]-4-oxo-3-[[(2R)-2-oxolanyl]methyl]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-methylsulfanylethylsulfanyl)-4-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazoline-7-carboxylate Traditional Name: 4-keto-2-[2-(methylthio)ethylthio]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxylic acid methyl ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCSC)CC3CCCO3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCSC)C[C@H]3CCCO3

InChI

InChI=1S/C18H22N2O4S2/c1-23-17(22)12-5-6-14-15(10-12)19-18(26-9-8-25-2)20(16(14)21)11-13-4-3-7-24-13/h5-6,10,13H,3-4,7-9,11H2,1-2H3/t13-/m1/s1