3-(phenylmethyl)-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(phenylmethyl)-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzyl-4-(3-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(phenylmethyl)-4-(3-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzyl-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-benzyl-4-(3-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C14H12N4S MolecularWeight: 268.33688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(=S)N2C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(=S)N2C3=CN=CC=C3

InChI

InChI=1S/C14H12N4S/c19-14-17-16-13(9-11-5-2-1-3-6-11)18(14)12-7-4-8-15-10-12/h1-8,10H,9H2,(H,17,19)