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

Systemtic Name: methyl 2-[4-oxidanylidene-2-(3-phenoxypropylsulfanyl)quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-(3-phenoxypropylsulfanyl)quinazolin-3-yl]acetate CAS Name: 2-[4-oxo-2-(3-phenoxypropylthio)-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-(3-phenoxypropylsulfanyl)quinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-(3-phenoxypropylthio)quinazolin-3-yl]acetic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCCCOC3=CC=CC=C3

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCCCOC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4S/c1-25-18(23)14-22-19(24)16-10-5-6-11-17(16)21-20(22)27-13-7-12-26-15-8-3-2-4-9-15/h2-6,8-11H,7,12-14H2,1H3