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

Systemtic Name: 5-(oxan-2-ylmethylsulfanyl)-N-[4-(trifluoromethyloxy)phenyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-(tetrahydropyran-2-ylmethylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-(2-oxanylmethylthio)-N-[4-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(oxan-2-ylmethylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-(tetrahydropyran-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]-[4-(trifluoromethoxy)phenyl]amine Formula: C15H16F3N3O2S2 MolecularWeight: 391.43165

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(S2)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(S2)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C15H16F3N3O2S2/c16-15(17,18)23-11-6-4-10(5-7-11)19-13-20-21-14(25-13)24-9-12-3-1-2-8-22-12/h4-7,12H,1-3,8-9H2,(H,19,20)