N-propan-2-yl-5-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-propan-2-yl-5-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-isopropyl-5-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-propan-2-yl-5-[[2-(trifluoromethyl)phenyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-propan-2-yl-5-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: isopropyl-[5-[[2-(trifluoromethyl)benzyl]thio]-1,3,4-thiadiazol-2-yl]amine Formula: C13H14F3N3S2 MolecularWeight: 333.39557

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN=C(S1)SCC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC(C)NC1=NN=C(S1)SCC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H14F3N3S2/c1-8(2)17-11-18-19-12(21-11)20-7-9-5-3-4-6-10(9)13(14,15)16/h3-6,8H,7H2,1-2H3,(H,17,18)