3-[(3-bromophenyl)methylsulfanyl]-5-pyridin-2-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-5-pyridin-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(2-pyridyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-bromophenyl)methylthio]-5-(2-pyridinyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-5-pyridin-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-bromobenzyl)thio]-5-(2-pyridyl)-1,2,4-triazol-4-yl]amine Formula: C14H12BrN5S MolecularWeight: 362.24758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=NC(=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C14H12BrN5S/c15-11-5-3-4-10(8-11)9-21-14-19-18-13(20(14)16)12-6-1-2-7-17-12/h1-8H,9,16H2