N-(5-bromanylquinolin-8-yl)-2-(4-nitrophenyl)sulfanyl-benzamide

Systemtic Name: N-(5-bromanylquinolin-8-yl)-2-(4-nitrophenyl)sulfanyl-benzamide Openeye Name: N-(5-bromo-8-quinolyl)-2-(4-nitrophenyl)sulfanyl-benzamide CAS Name: N-(5-bromo-8-quinolinyl)-2-[(4-nitrophenyl)thio]benzamide IUPAC Name: N-(5-bromoquinolin-8-yl)-2-(4-nitrophenyl)sulfanylbenzamide Traditional Name: N-(5-bromo-8-quinolyl)-2-[(4-nitrophenyl)thio]benzamide Formula: C22H14BrN3O3S MolecularWeight: 480.33386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14BrN3O3S/c23-18-11-12-19(21-16(18)5-3-13-24-21)25-22(27)17-4-1-2-6-20(17)30-15-9-7-14(8-10-15)26(28)29/h1-13H,(H,25,27)