2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]ethanamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]-2-(2,4-dibromo-6-methyl-phenoxy)acetamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]-2-(2,4-dibromo-6-methylphenoxy)acetamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]-2-(2,4-dibromo-6-methylphenoxy)acetamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]-2-(2,4-dibromo-6-methyl-phenoxy)acetamide Formula: C16H12Br2ClN3O4S MolecularWeight: 537.61018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12Br2ClN3O4S/c1-8-4-9(17)5-11(18)15(8)26-7-14(23)21-16(27)20-10-2-3-12(19)13(6-10)22(24)25/h2-6H,7H2,1H3,(H2,20,21,23,27)