6-[(4-chlorophenyl)methyl]-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione

Systemtic Name: 6-[(4-chlorophenyl)methyl]-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione Openeye Name: 6-[(4-chlorophenyl)methyl]-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione CAS Name: 6-[(4-chlorophenyl)methyl]-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione IUPAC Name: 6-[(4-chlorophenyl)methyl]-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione Traditional Name: 6-(4-chlorobenzyl)-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione Formula: C14H13ClN4S MolecularWeight: 304.79782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=NC(=S)NN12)C)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NC2=NC(=S)NN12)C)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H13ClN4S/c1-8-12(7-10-3-5-11(15)6-4-10)9(2)19-13(16-8)17-14(20)18-19/h3-6H,7H2,1-2H3,(H,18,20)