3-chloranyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline

Systemtic Name: 3-chloranyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: 3-chloro-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: 3-chloro-4-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: 3-chloro-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: [3-chloro-4-(1H-1,2,4-triazol-5-ylthio)phenyl]amine Formula: C8H7ClN4S MolecularWeight: 226.68598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)Cl)SC2=NC=NN2

Isomeric SMILES

C1=CC(=C(C=C1N)Cl)SC2=NC=NN2

InChI

InChI=1S/C8H7ClN4S/c9-6-3-5(10)1-2-7(6)14-8-11-4-12-13-8/h1-4H,10H2,(H,11,12,13)