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

Systemtic Name: methyl 2-[4-oxidanylidene-2-(3-oxidanylidenebutylsulfanyl)quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-(3-oxobutylsulfanyl)quinazolin-3-yl]acetate CAS Name: 2-[4-oxo-2-(3-oxobutylthio)-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-(3-oxobutylsulfanyl)quinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-(3-ketobutylthio)quinazolin-3-yl]acetic acid methyl ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

Isomeric SMILES

CC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

InChI

InChI=1S/C15H16N2O4S/c1-10(18)7-8-22-15-16-12-6-4-3-5-11(12)14(20)17(15)9-13(19)21-2/h3-6H,7-9H2,1-2H3