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

Systemtic Name: 3-[(4-aminophenyl)methylsulfanyl]-5-(2-methylpropyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4-aminophenyl)methylsulfanyl]-5-isobutyl-1,2,4-triazol-4-amine CAS Name: 3-[(4-aminophenyl)methylthio]-5-(2-methylpropyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-aminophenyl)methylsulfanyl]-5-(2-methylpropyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4-aminobenzyl)thio]-5-isobutyl-1,2,4-triazol-4-yl]amine Formula: C13H19N5S MolecularWeight: 277.38846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(N1N)SCC2=CC=C(C=C2)N

Isomeric SMILES

CC(C)CC1=NN=C(N1N)SCC2=CC=C(C=C2)N

InChI

InChI=1S/C13H19N5S/c1-9(2)7-12-16-17-13(18(12)15)19-8-10-3-5-11(14)6-4-10/h3-6,9H,7-8,14-15H2,1-2H3