N-(2-bromanyl-4-nitro-phenyl)-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-2-(8-quinolylsulfanyl)acetamide CAS Name: N-(2-bromo-4-nitrophenyl)-2-(8-quinolinylthio)acetamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-2-(8-quinolylthio)acetamide Formula: C17H12BrN3O3S MolecularWeight: 418.26448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)N=CC=C2

InChI

InChI=1S/C17H12BrN3O3S/c18-13-9-12(21(23)24)6-7-14(13)20-16(22)10-25-15-5-1-3-11-4-2-8-19-17(11)15/h1-9H,10H2,(H,20,22)