3-[(4-aminophenyl)methylsulfanyl]-5-(propan-2-ylsulfanylmethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-aminophenyl)methylsulfanyl]-5-(propan-2-ylsulfanylmethyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4-aminophenyl)methylsulfanyl]-5-(isopropylsulfanylmethyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4-aminophenyl)methylthio]-5-[(propan-2-ylthio)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-aminophenyl)methylsulfanyl]-5-(propan-2-ylsulfanylmethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4-aminobenzyl)thio]-5-[(isopropylthio)methyl]-1,2,4-triazol-4-yl]amine Formula: C13H19N5S2 MolecularWeight: 309.45346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=NN=C(N1N)SCC2=CC=C(C=C2)N

Isomeric SMILES

CC(C)SCC1=NN=C(N1N)SCC2=CC=C(C=C2)N

InChI

InChI=1S/C13H19N5S2/c1-9(2)19-8-12-16-17-13(18(12)15)20-7-10-3-5-11(14)6-4-10/h3-6,9H,7-8,14-15H2,1-2H3