N-[(4-ethylphenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: N-[(4-ethylphenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: N-[(4-ethylphenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: N-[(4-ethylphenyl)methyl]-3-[(2-fluorophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: N-[(4-ethylphenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: (4-ethylbenzyl)-[3-[(2-fluorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C18H19FN4S MolecularWeight: 342.433663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=CC=C3F

Isomeric SMILES

CCC1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=CC=C3F

InChI

InChI=1S/C18H19FN4S/c1-2-14-7-9-15(10-8-14)11-21-23-13-20-22-18(23)24-12-16-5-3-4-6-17(16)19/h3-10,13,21H,2,11-12H2,1H3