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

Systemtic Name: 1-[4-[(4-methylphenyl)methyl]-5-methylsulfanyl-1,2,4-triazol-3-yl]propan-1-amine Openeye Name: 1-[5-methylsulfanyl-4-(p-tolylmethyl)-1,2,4-triazol-3-yl]propan-1-amine CAS Name: 1-[4-[(4-methylphenyl)methyl]-5-(methylthio)-1,2,4-triazol-3-yl]-1-propanamine IUPAC Name: 1-[4-[(4-methylphenyl)methyl]-5-methylsulfanyl-1,2,4-triazol-3-yl]propan-1-amine Traditional Name: 1-[4-(4-methylbenzyl)-5-(methylthio)-1,2,4-triazol-3-yl]propylamine Formula: C14H20N4S MolecularWeight: 276.4004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=C(N1CC2=CC=C(C=C2)C)SC)N

Isomeric SMILES

CCC(C1=NN=C(N1CC2=CC=C(C=C2)C)SC)N

InChI

InChI=1S/C14H20N4S/c1-4-12(15)13-16-17-14(19-3)18(13)9-11-7-5-10(2)6-8-11/h5-8,12H,4,9,15H2,1-3H3