1-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]ethanamine

Systemtic Name: 1-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]ethanamine Openeye Name: 1-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]ethanamine CAS Name: 1-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]ethanamine IUPAC Name: 1-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]ethanamine Traditional Name: 1-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]ethylamine Formula: C10H12N4S MolecularWeight: 220.29408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC2=NC=NN2)N

Isomeric SMILES

CC(C1=CC=C(C=C1)SC2=NC=NN2)N

InChI

InChI=1S/C10H12N4S/c1-7(11)8-2-4-9(5-3-8)15-10-12-6-13-14-10/h2-7H,11H2,1H3,(H,12,13,14)