2-(2-bromanyl-4-methyl-phenoxy)-N-[(3-nitrophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-methyl-phenoxy)-N-[(3-nitrophenyl)carbamothioyl]ethanamide Openeye Name: 2-(2-bromo-4-methyl-phenoxy)-N-[(3-nitrophenyl)carbamothioyl]acetamide CAS Name: 2-(2-bromo-4-methylphenoxy)-N-[(3-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-methylphenoxy)-N-[(3-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(2-bromo-4-methyl-phenoxy)-N-[(3-nitrophenyl)thiocarbamoyl]acetamide Formula: C16H14BrN3O4S MolecularWeight: 424.26906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C16H14BrN3O4S/c1-10-5-6-14(13(17)7-10)24-9-15(21)19-16(25)18-11-3-2-4-12(8-11)20(22)23/h2-8H,9H2,1H3,(H2,18,19,21,25)