5-ethylsulfanyl-4-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-amine

Systemtic Name: 5-ethylsulfanyl-4-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-amine Openeye Name: 5-ethylsulfanyl-4-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-amine CAS Name: 5-(ethylthio)-4-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-amine IUPAC Name: 5-ethylsulfanyl-4-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-amine Traditional Name: [5-(ethylthio)-4-(4-fluorobenzyl)-1,2,4-triazol-3-yl]amine Formula: C11H13FN4S MolecularWeight: 252.311123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1CC2=CC=C(C=C2)F)N

Isomeric SMILES

CCSC1=NN=C(N1CC2=CC=C(C=C2)F)N

InChI

InChI=1S/C11H13FN4S/c1-2-17-11-15-14-10(13)16(11)7-8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3,(H2,13,14)