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

Systemtic Name: 2-(4-bromanyl-3-methyl-phenoxy)-N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-3-methyl-phenoxy)-N-[(4-chloro-3-nitro-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromo-3-methylphenoxy)-N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-3-methylphenoxy)-N-[(4-chloro-3-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-3-methyl-phenoxy)-N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]acetamide Formula: C16H13BrClN3O4S MolecularWeight: 458.71412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrClN3O4S/c1-9-6-11(3-4-12(9)17)25-8-15(22)20-16(26)19-10-2-5-13(18)14(7-10)21(23)24/h2-7H,8H2,1H3,(H2,19,20,22,26)