4-(3-chloranyl-2-methyl-phenyl)-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-chloranyl-2-methyl-phenyl)-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-chloro-2-methyl-phenyl)-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-chloro-2-methylphenyl)-3-(3-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-chloro-2-methylphenyl)-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-chloro-2-methyl-phenyl)-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C14H11ClN4S MolecularWeight: 302.78194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=NNC2=S)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=NNC2=S)C3=CN=CC=C3

InChI

InChI=1S/C14H11ClN4S/c1-9-11(15)5-2-6-12(9)19-13(17-18-14(19)20)10-4-3-7-16-8-10/h2-8H,1H3,(H,18,20)