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

Systemtic Name: methyl 3-(furan-2-ylmethyl)-4-oxidanylidene-2-(2-phenoxyethylsulfanyl)quinazoline-7-carboxylate Openeye Name: methyl 3-(2-furylmethyl)-4-oxo-2-(2-phenoxyethylsulfanyl)quinazoline-7-carboxylate CAS Name: 3-(2-furanylmethyl)-4-oxo-2-(2-phenoxyethylthio)-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(furan-2-ylmethyl)-4-oxo-2-(2-phenoxyethylsulfanyl)quinazoline-7-carboxylate Traditional Name: 3-(2-furfuryl)-4-keto-2-(2-phenoxyethylthio)quinazoline-7-carboxylic acid methyl ester Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O5S/c1-28-22(27)16-9-10-19-20(14-16)24-23(25(21(19)26)15-18-8-5-11-29-18)31-13-12-30-17-6-3-2-4-7-17/h2-11,14H,12-13,15H2,1H3