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

Systemtic Name: 2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(2-phenylsulfanylethyl)ethanamide Openeye Name: 2-(6-nitro-4-oxo-quinazolin-3-yl)-N-(2-phenylsulfanylethyl)acetamide CAS Name: 2-(6-nitro-4-oxo-3-quinazolinyl)-N-[2-(phenylthio)ethyl]acetamide IUPAC Name: 2-(6-nitro-4-oxoquinazolin-3-yl)-N-(2-phenylsulfanylethyl)acetamide Traditional Name: 2-(4-keto-6-nitro-quinazolin-3-yl)-N-[2-(phenylthio)ethyl]acetamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O4S/c23-17(19-8-9-27-14-4-2-1-3-5-14)11-21-12-20-16-7-6-13(22(25)26)10-15(16)18(21)24/h1-7,10,12H,8-9,11H2,(H,19,23)