methyl 3-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]propanoate

Systemtic Name: methyl 3-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]propanoate Openeye Name: methyl 3-[[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]methylsulfanyl]propanoate CAS Name: 3-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]methylthio]propanoic acid methyl ester IUPAC Name: methyl 3-[[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]methylsulfanyl]propanoate Traditional Name: 3-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]methylthio]propionic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CO3

Isomeric SMILES

COC(=O)CCSCC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CO3

InChI

InChI=1S/C18H18N2O4S/c1-23-17(21)8-10-25-12-16-19-15-7-3-2-6-14(15)18(22)20(16)11-13-5-4-9-24-13/h2-7,9H,8,10-12H2,1H3