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

Systemtic Name: methyl 3-(furan-2-ylmethyl)-2-(2-hydroxyethylsulfanyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-(2-furylmethyl)-2-(2-hydroxyethylsulfanyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 3-(2-furanylmethyl)-2-(2-hydroxyethylthio)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(furan-2-ylmethyl)-2-(2-hydroxyethylsulfanyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-(2-furfuryl)-2-(2-hydroxyethylthio)-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5S/c1-23-16(22)11-4-5-13-14(9-11)18-17(25-8-6-20)19(15(13)21)10-12-3-2-7-24-12/h2-5,7,9,20H,6,8,10H2,1H3