N-[(2-bromanyl-4-methyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[(2-bromanyl-4-methyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[(2-bromo-4-methyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(2-bromo-4-methylanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(2-bromo-4-methylphenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(2-bromo-4-methyl-phenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C16H14BrN3O4S MolecularWeight: 424.26906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

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