2-(4-bromanylphenoxy)-N-[[2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[[2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[[2-(p-tolyl)benzotriazol-5-yl]carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[[2-(4-methylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[[2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[[2-(p-tolyl)benzotriazol-5-yl]thiocarbamoyl]acetamide Formula: C22H18BrN5O2S MolecularWeight: 496.37962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrN5O2S/c1-14-2-7-17(8-3-14)28-26-19-11-6-16(12-20(19)27-28)24-22(31)25-21(29)13-30-18-9-4-15(23)5-10-18/h2-12H,13H2,1H3,(H2,24,25,29,31)