N-(3-methylsulfanylphenyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(3-methylsulfanylphenyl)-2-(6-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[3-(methylthio)phenyl]-2-(6-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(3-methylsulfanylphenyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: 2-(4-keto-6-nitro-quinazolin-3-yl)-N-[3-(methylthio)phenyl]acetamide Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O4S/c1-26-13-4-2-3-11(7-13)19-16(22)9-20-10-18-15-6-5-12(21(24)25)8-14(15)17(20)23/h2-8,10H,9H2,1H3,(H,19,22)