methyl 2-[2-(4-fluoranylphenoxy)ethylsulfanyl]-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-(4-fluoranylphenoxy)ethylsulfanyl]-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-(4-fluorophenoxy)ethylsulfanyl]-3-(2-furylmethyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[2-(4-fluorophenoxy)ethylthio]-3-(2-furanylmethyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-fluorophenoxy)ethylsulfanyl]-3-(furan-2-ylmethyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[2-(4-fluorophenoxy)ethylthio]-3-(2-furfuryl)-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C23H19FN2O5S MolecularWeight: 454.470763

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)F)CC4=CC=CO4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)F)CC4=CC=CO4

InChI

InChI=1S/C23H19FN2O5S/c1-29-22(28)15-4-9-19-20(13-15)25-23(26(21(19)27)14-18-3-2-10-30-18)32-12-11-31-17-7-5-16(24)6-8-17/h2-10,13H,11-12,14H2,1H3