methyl 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate Openeye Name: methyl 2-[(1,3-dioxoisoindolin-2-yl)methylsulfanyl]-4-oxo-3-phenyl-quinazoline-7-carboxylate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)methylthio]-4-oxo-3-phenyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]-4-oxo-3-phenylquinazoline-7-carboxylate Traditional Name: 4-keto-3-phenyl-2-(phthalimidomethylthio)quinazoline-7-carboxylic acid methyl ester Formula: C25H17N3O5S MolecularWeight: 471.48458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C25H17N3O5S/c1-33-24(32)15-11-12-19-20(13-15)26-25(28(23(19)31)16-7-3-2-4-8-16)34-14-27-21(29)17-9-5-6-10-18(17)22(27)30/h2-13H,14H2,1H3