N-(4-nitrophenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-nitrophenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(4-nitrophenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(4-nitrophenyl)-2-[(2-phenyl-4-benzo[h]quinazolinyl)thio]acetamide IUPAC Name: N-(4-nitrophenyl)-2-(2-phenylbenzo[h]quinazolin-4-yl)sulfanylacetamide Traditional Name: N-(4-nitrophenyl)-2-[(2-phenylbenzo[h]quinazolin-4-yl)thio]acetamide Formula: C26H18N4O3S MolecularWeight: 466.51112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=CC4=CC=CC=C43)C(=N2)SCC(=O)NC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=CC4=CC=CC=C43)C(=N2)SCC(=O)NC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H18N4O3S/c31-23(27-19-11-13-20(14-12-19)30(32)33)16-34-26-22-15-10-17-6-4-5-9-21(17)24(22)28-25(29-26)18-7-2-1-3-8-18/h1-15H,16H2,(H,27,31)