2-(4-bromanylphenoxy)-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]acetamide Formula: C16H14BrN3O4S MolecularWeight: 424.26906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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