methyl 3-(furan-2-ylmethyl)-2-(2-methylsulfanylethylsulfanyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-(furan-2-ylmethyl)-2-(2-methylsulfanylethylsulfanyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-(2-furylmethyl)-2-(2-methylsulfanylethylsulfanyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 3-(2-furanylmethyl)-2-[2-(methylthio)ethylthio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(furan-2-ylmethyl)-2-(2-methylsulfanylethylsulfanyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-(2-furfuryl)-4-keto-2-[2-(methylthio)ethylthio]quinazoline-7-carboxylic acid methyl ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCSC)CC3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCSC)CC3=CC=CO3

InChI

InChI=1S/C18H18N2O4S2/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/h3-7,10H,8-9,11H2,1-2H3