3-(4-methylphenyl)-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-methylphenyl)-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-(p-tolyl)-5-[2-(4-pyridyl)ethylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(4-methylphenyl)-5-(2-pyridin-4-ylethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-(4-methylphenyl)-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-(p-tolyl)-5-[2-(4-pyridyl)ethylthio]-1,2,4-triazol-4-yl]amine Formula: C16H17N5S MolecularWeight: 311.40468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2N)SCCC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2N)SCCC3=CC=NC=C3

InChI

InChI=1S/C16H17N5S/c1-12-2-4-14(5-3-12)15-19-20-16(21(15)17)22-11-8-13-6-9-18-10-7-13/h2-7,9-10H,8,11,17H2,1H3