3-[2-(2-fluorophenyl)sulfanylethylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(2-fluorophenyl)sulfanylethylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Openeye Name: 3-[2-(2-fluorophenyl)sulfanylethylsulfanyl]-5-(1-naphthylmethyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-[(2-fluorophenyl)thio]ethylthio]-5-(1-naphthalenylmethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(2-fluorophenyl)sulfanylethylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[2-[(2-fluorophenyl)thio]ethylthio]-5-(1-naphthylmethyl)-1,2,4-triazol-4-yl]amine Formula: C21H19FN4S2 MolecularWeight: 410.530763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC3=NN=C(N3N)SCCSC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC3=NN=C(N3N)SCCSC4=CC=CC=C4F

InChI

InChI=1S/C21H19FN4S2/c22-18-10-3-4-11-19(18)27-12-13-28-21-25-24-20(26(21)23)14-16-8-5-7-15-6-1-2-9-17(15)16/h1-11H,12-14,23H2