methyl 3-[4-oxidanylidene-2-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]sulfanyl-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]sulfanyl-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[2-(2-allylsulfanylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[[2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl]thio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl]sulfanylquinazolin-3-yl]propanoate Traditional Name: 3-[2-[[2-[2-(allylthio)anilino]-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C23H23N3O4S2 MolecularWeight: 469.57642

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3SCC=C

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3SCC=C

InChI

InChI=1S/C23H23N3O4S2/c1-3-14-31-19-11-7-6-10-18(19)24-20(27)15-32-23-25-17-9-5-4-8-16(17)22(29)26(23)13-12-21(28)30-2/h3-11H,1,12-15H2,2H3,(H,24,27)