2-[[1-(2,4-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide

Systemtic Name: 2-[[1-(2,4-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide Openeye Name: 2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]acetamide CAS Name: 2-[[1-(2,4-dimethylphenyl)-5-tetrazolyl]thio]-N-[4-(trifluoromethoxy)phenyl]acetamide IUPAC Name: 2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]acetamide Traditional Name: 2-[[1-(2,4-dimethylphenyl)tetrazol-5-yl]thio]-N-[4-(trifluoromethoxy)phenyl]acetamide Formula: C18H16F3N5O2S MolecularWeight: 423.41215

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=CC=C(C=C3)OC(F)(F)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=CC=C(C=C3)OC(F)(F)F)C

InChI

InChI=1S/C18H16F3N5O2S/c1-11-3-8-15(12(2)9-11)26-17(23-24-25-26)29-10-16(27)22-13-4-6-14(7-5-13)28-18(19,20)21/h3-9H,10H2,1-2H3,(H,22,27)