methyl 7-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate

Systemtic Name: methyl 7-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate Openeye Name: methyl 7-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate CAS Name: 7-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylic acid methyl ester IUPAC Name: methyl 7-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate Traditional Name: 7-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylic acid methyl ester Formula: C14H11ClN4O2 MolecularWeight: 302.71574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NN=C(N12)C(=O)OC)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=NC2=NN=C(N12)C(=O)OC)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H11ClN4O2/c1-8-7-11(9-3-5-10(15)6-4-9)16-14-18-17-12(19(8)14)13(20)21-2/h3-7H,1-2H3