N-(2-bromanyl-4-nitro-phenyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide CAS Name: N-(2-bromo-4-nitrophenyl)-2-[methyl-[[4-(methylthio)phenyl]methyl]amino]acetamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-2-[methyl-[4-(methylthio)benzyl]amino]acetamide Formula: C17H18BrN3O3S MolecularWeight: 424.31212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C17H18BrN3O3S/c1-20(10-12-3-6-14(25-2)7-4-12)11-17(22)19-16-8-5-13(21(23)24)9-15(16)18/h3-9H,10-11H2,1-2H3,(H,19,22)