N-[1-(5-chloranyl-6-methyl-benzotriazol-2-yl)-2-cyano-propan-2-yl]-4-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: N-[1-(5-chloranyl-6-methyl-benzotriazol-2-yl)-2-cyano-propan-2-yl]-4-(trifluoromethyl)benzenecarbothioamide Openeye Name: N-[2-(5-chloro-6-methyl-benzotriazol-2-yl)-1-cyano-1-methyl-ethyl]-4-(trifluoromethyl)benzenecarbothioamide CAS Name: N-[1-(5-chloro-6-methyl-2-benzotriazolyl)-2-cyanopropan-2-yl]-4-(trifluoromethyl)benzenecarbothioamide IUPAC Name: N-[1-(5-chloro-6-methylbenzotriazol-2-yl)-2-cyanopropan-2-yl]-4-(trifluoromethyl)benzenecarbothioamide Traditional Name: N-[2-(5-chloro-6-methyl-benzotriazol-2-yl)-1-cyano-1-methyl-ethyl]-4-(trifluoromethyl)thiobenzamide Formula: C19H15ClF3N5S MolecularWeight: 437.86911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1Cl)CC(C)(C#N)NC(=S)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1Cl)CC(C)(C#N)NC(=S)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H15ClF3N5S/c1-11-7-15-16(8-14(11)20)27-28(26-15)10-18(2,9-24)25-17(29)12-3-5-13(6-4-12)19(21,22)23/h3-8H,10H2,1-2H3,(H,25,29)