5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[3,5-bis(trifluoromethyl)benzyl]-1,3,4-thiadiazol-2-yl]amine Formula: C11H7F6N3S MolecularWeight: 327.248799

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CC2=NN=C(S2)N

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CC2=NN=C(S2)N

InChI

InChI=1S/C11H7F6N3S/c12-10(13,14)6-1-5(2-7(4-6)11(15,16)17)3-8-19-20-9(18)21-8/h1-2,4H,3H2,(H2,18,20)