5-(3-fluorophenyl)-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(3-fluorophenyl)-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(3-fluorophenyl)-N-isobutyl-1,3,4-thiadiazol-2-amine CAS Name: 5-(3-fluorophenyl)-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(3-fluorophenyl)-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(3-fluorophenyl)-1,3,4-thiadiazol-2-yl]-isobutyl-amine Formula: C12H14FN3S MolecularWeight: 251.323063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)C2=CC(=CC=C2)F

Isomeric SMILES

CC(C)CNC1=NN=C(S1)C2=CC(=CC=C2)F

InChI

InChI=1S/C12H14FN3S/c1-8(2)7-14-12-16-15-11(17-12)9-4-3-5-10(13)6-9/h3-6,8H,7H2,1-2H3,(H,14,16)