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

Systemtic Name: methyl 4-oxidanylidene-2-(2-phenoxyethylsulfanyl)-3-phenyl-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-(2-phenoxyethylsulfanyl)-3-phenyl-quinazoline-7-carboxylate CAS Name: 4-oxo-2-(2-phenoxyethylthio)-3-phenyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-(2-phenoxyethylsulfanyl)-3-phenylquinazoline-7-carboxylate Traditional Name: 4-keto-2-(2-phenoxyethylthio)-3-phenyl-quinazoline-7-carboxylic acid methyl ester Formula: C24H20N2O4S MolecularWeight: 432.4916

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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)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCOC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H20N2O4S/c1-29-23(28)17-12-13-20-21(16-17)25-24(26(22(20)27)18-8-4-2-5-9-18)31-15-14-30-19-10-6-3-7-11-19/h2-13,16H,14-15H2,1H3