ethyl 2-[3-(4-nitrophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: ethyl 2-[3-(4-nitrophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: ethyl 2-[3-(4-nitrophenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoate CAS Name: 2-[[3-(4-nitrophenyl)-4-oxo-2-quinazolinyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-nitrophenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: 2-[[4-keto-3-(4-nitrophenyl)quinazolin-2-yl]thio]propionic acid ethyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5S/c1-3-27-18(24)12(2)28-19-20-16-7-5-4-6-15(16)17(23)21(19)13-8-10-14(11-9-13)22(25)26/h4-12H,3H2,1-2H3