3-(3-azanylpropylsulfanyl)-5-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(3-azanylpropylsulfanyl)-5-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-(3-aminopropylsulfanyl)-5-(p-tolylmethyl)-1,2,4-triazol-4-amine CAS Name: 3-(3-aminopropylthio)-5-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-(3-aminopropylsulfanyl)-5-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: 3-[[4-amino-5-(4-methylbenzyl)-1,2,4-triazol-3-yl]thio]propylamine Formula: C13H19N5S MolecularWeight: 277.38846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NN=C(N2N)SCCCN

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NN=C(N2N)SCCCN

InChI

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