N-(4-nitrophenyl)-2-(2-phenylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-nitrophenyl)-2-(2-phenylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(4-nitrophenyl)-2-(2-phenylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(4-nitrophenyl)-2-[(2-phenyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(4-nitrophenyl)-2-(2-phenylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(4-nitrophenyl)-2-[(2-phenylquinazolin-4-yl)thio]acetamide Formula: C22H16N4O3S MolecularWeight: 416.45244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O3S/c27-20(23-16-10-12-17(13-11-16)26(28)29)14-30-22-18-8-4-5-9-19(18)24-21(25-22)15-6-2-1-3-7-15/h1-13H,14H2,(H,23,27)