N-methyl-2-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-amine

Systemtic Name: N-methyl-2-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-amine Openeye Name: 5-benzylsulfanyl-N-methyl-2-phenyl-1,2,4-triazol-3-amine CAS Name: N-methyl-2-phenyl-5-(phenylmethylthio)-1,2,4-triazol-3-amine IUPAC Name: 5-benzylsulfanyl-N-methyl-2-phenyl-1,2,4-triazol-3-amine Traditional Name: [5-(benzylthio)-2-phenyl-1,2,4-triazol-3-yl]-methyl-amine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NN1C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

CNC1=NC(=NN1C2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H16N4S/c1-17-15-18-16(21-12-13-8-4-2-5-9-13)19-20(15)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,17,18,19)