2,2,2-tris(chloranyl)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]ethanamide

Systemtic Name: 2,2,2-tris(chloranyl)-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]ethanamide Openeye Name: 2,2,2-trichloro-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]acetamide CAS Name: 2,2,2-trichloro-N-[[(6-methyl-2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2,2,2-trichloro-N-[(6-methyl-2-phenylbenzotriazol-5-yl)carbamothioyl]acetamide Traditional Name: 2,2,2-trichloro-N-[(6-methyl-2-phenyl-benzotriazol-5-yl)thiocarbamoyl]acetamide Formula: C16H12Cl3N5OS MolecularWeight: 428.72338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C(Cl)(Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C(Cl)(Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H12Cl3N5OS/c1-9-7-12-13(23-24(22-12)10-5-3-2-4-6-10)8-11(9)20-15(26)21-14(25)16(17,18)19/h2-8H,1H3,(H2,20,21,25,26)