2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-[(4-nitrophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-[(4-nitrophenyl)carbamothioyl]ethanamide Openeye Name: 2-(2,4-dibromo-6-methyl-phenoxy)-N-[(4-nitrophenyl)carbamothioyl]acetamide CAS Name: 2-(2,4-dibromo-6-methylphenoxy)-N-[(4-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2,4-dibromo-6-methylphenoxy)-N-[(4-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(2,4-dibromo-6-methyl-phenoxy)-N-[(4-nitrophenyl)thiocarbamoyl]acetamide Formula: C16H13Br2N3O4S MolecularWeight: 503.16512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Br)Br

InChI

InChI=1S/C16H13Br2N3O4S/c1-9-6-10(17)7-13(18)15(9)25-8-14(22)20-16(26)19-11-2-4-12(5-3-11)21(23)24/h2-7H,8H2,1H3,(H2,19,20,22,26)