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

Systemtic Name: 3-[(4-aminophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[(4-aminophenyl)methylsulfanyl]-5-isopropyl-1,2,4-triazol-4-amine CAS Name: 3-[(4-aminophenyl)methylthio]-5-propan-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-aminophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[(4-aminobenzyl)thio]-5-isopropyl-1,2,4-triazol-4-yl]amine Formula: C12H17N5S MolecularWeight: 263.36188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1N)SCC2=CC=C(C=C2)N

Isomeric SMILES

CC(C)C1=NN=C(N1N)SCC2=CC=C(C=C2)N

InChI

InChI=1S/C12H17N5S/c1-8(2)11-15-16-12(17(11)14)18-7-9-3-5-10(13)6-4-9/h3-6,8H,7,13-14H2,1-2H3