5-(2-methylpropylsulfanyl)-N-[4-(trifluoromethyloxy)phenyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(2-methylpropylsulfanyl)-N-[4-(trifluoromethyloxy)phenyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-isobutylsulfanyl-N-[4-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-(2-methylpropylthio)-N-[4-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(2-methylpropylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-(isobutylthio)-1,3,4-thiadiazol-2-yl]-[4-(trifluoromethoxy)phenyl]amine Formula: C13H14F3N3OS2 MolecularWeight: 349.39497

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(S1)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CC(C)CSC1=NN=C(S1)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C13H14F3N3OS2/c1-8(2)7-21-12-19-18-11(22-12)17-9-3-5-10(6-4-9)20-13(14,15)16/h3-6,8H,7H2,1-2H3,(H,17,18)