methyl 2-[2-[1-(3-nitrophenyl)ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[1-(3-nitrophenyl)ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[1-(3-nitrophenyl)ethylsulfanyl]-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[1-(3-nitrophenyl)ethylthio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[1-(3-nitrophenyl)ethylsulfanyl]-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[1-(3-nitrophenyl)ethylthio]quinazolin-3-yl]acetic acid methyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

InChI

InChI=1S/C19H17N3O5S/c1-12(13-6-5-7-14(10-13)22(25)26)28-19-20-16-9-4-3-8-15(16)18(24)21(19)11-17(23)27-2/h3-10,12H,11H2,1-2H3