N-(2-phenylphenyl)-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: N-(2-phenylphenyl)-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Openeye Name: N-(2-phenylphenyl)-3-(4-pyridylmethylsulfanyl)-1H-1,2,4-triazol-5-amine CAS Name: N-(2-phenylphenyl)-3-(pyridin-4-ylmethylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: N-(2-phenylphenyl)-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Traditional Name: (2-phenylphenyl)-[3-(4-pyridylmethylthio)-1H-1,2,4-triazol-5-yl]amine Formula: C20H17N5S MolecularWeight: 359.44748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2NC3=NC(=NN3)SCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2NC3=NC(=NN3)SCC4=CC=NC=C4

InChI

InChI=1S/C20H17N5S/c1-2-6-16(7-3-1)17-8-4-5-9-18(17)22-19-23-20(25-24-19)26-14-15-10-12-21-13-11-15/h1-13H,14H2,(H2,22,23,24,25)