N-(pyridin-2-ylmethyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline

Systemtic Name: N-(pyridin-2-ylmethyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: N-(2-pyridylmethyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: N-(2-pyridinylmethyl)-4-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: N-(pyridin-2-ylmethyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: 2-pyridylmethyl-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]amine Formula: C14H13N5S MolecularWeight: 283.35152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC2=CC=C(C=C2)SC3=NC=NN3

Isomeric SMILES

C1=CC=NC(=C1)CNC2=CC=C(C=C2)SC3=NC=NN3

InChI

InChI=1S/C14H13N5S/c1-2-8-15-12(3-1)9-16-11-4-6-13(7-5-11)20-14-17-10-18-19-14/h1-8,10,16H,9H2,(H,17,18,19)