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

Systemtic Name: N-(3-methylsulfanylpropyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: N-(3-methylsulfanylpropyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: N-[3-(methylthio)propyl]-4-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: N-(3-methylsulfanylpropyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: 3-(methylthio)propyl-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]amine Formula: C12H16N4S2 MolecularWeight: 280.41224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC1=CC=C(C=C1)SC2=NC=NN2

Isomeric SMILES

CSCCCNC1=CC=C(C=C1)SC2=NC=NN2

InChI

InChI=1S/C12H16N4S2/c1-17-8-2-7-13-10-3-5-11(6-4-10)18-12-14-9-15-16-12/h3-6,9,13H,2,7-8H2,1H3,(H,14,15,16)