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

Systemtic Name: 5-(2-chloranylpyridin-3-yl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-benzyl-5-(2-chloro-3-pyridyl)-1H-1,2,4-triazole-3-thione CAS Name: 5-(2-chloro-3-pyridinyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-benzyl-5-(2-chloropyridin-3-yl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-benzyl-5-(2-chloro-3-pyridyl)-1H-1,2,4-triazole-3-thione Formula: C14H11ClN4S MolecularWeight: 302.78194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=S)N=C(N2)C3=C(N=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=S)N=C(N2)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C14H11ClN4S/c15-12-11(7-4-8-16-12)13-17-14(20)19(18-13)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,17,18,20)