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

Systemtic Name: 3-[(4-chlorophenyl)methyl]-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-chlorophenyl)methyl]-4-(3-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-chlorophenyl)methyl]-4-(3-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-chlorophenyl)methyl]-4-pyridin-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-chlorobenzyl)-4-(3-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C14H11ClN4S MolecularWeight: 302.78194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)N2C(=NNC2=S)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)N2C(=NNC2=S)CC3=CC=C(C=C3)Cl

InChI

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