5-phenyl-2-[(pyridin-2-ylamino)methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-phenyl-2-[(pyridin-2-ylamino)methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 5-phenyl-2-[(2-pyridylamino)methyl]-1H-1,2,4-triazole-3-thione CAS Name: 5-phenyl-2-[(2-pyridinylamino)methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 5-phenyl-2-[(pyridin-2-ylamino)methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 5-phenyl-2-[(2-pyridylamino)methyl]-1H-1,2,4-triazole-3-thione Formula: C14H13N5S MolecularWeight: 283.35152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=S)N(N2)CNC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=S)N(N2)CNC3=CC=CC=N3

InChI

InChI=1S/C14H13N5S/c20-14-17-13(11-6-2-1-3-7-11)18-19(14)10-16-12-8-4-5-9-15-12/h1-9H,10H2,(H,15,16)(H,17,18,20)