3-(2-chloranyl-6-methyl-pyrimidin-4-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-chloranyl-6-methyl-pyrimidin-4-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-chloro-6-methyl-pyrimidin-4-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-chloro-6-methyl-4-pyrimidinyl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-chloro-6-methylpyrimidin-4-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-chloro-6-methyl-pyrimidin-4-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5-thione Formula: C13H9Cl2N5S MolecularWeight: 338.21506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=NC(=NC(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C13H9Cl2N5S/c1-7-6-10(17-12(15)16-7)11-18-19-13(21)20(11)9-4-2-8(14)3-5-9/h2-6H,1H3,(H,19,21)