methyl 3-[4-oxidanylidene-2-(3-phenoxypropylsulfanyl)quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-(3-phenoxypropylsulfanyl)quinazolin-3-yl]propanoate Openeye Name: methyl 3-[4-oxo-2-(3-phenoxypropylsulfanyl)quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-(3-phenoxypropylthio)-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-(3-phenoxypropylsulfanyl)quinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-(3-phenoxypropylthio)quinazolin-3-yl]propionic acid methyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCCCOC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCCCOC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S/c1-26-19(24)12-13-23-20(25)17-10-5-6-11-18(17)22-21(23)28-15-7-14-27-16-8-3-2-4-9-16/h2-6,8-11H,7,12-15H2,1H3