[2-[[2,6-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: [2-[[2,6-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: [2-(2,6-dichloroanilino)-2-oxo-ethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid [2-(2,6-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dichloroanilino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid [2-(2,6-dichloroanilino)-2-keto-ethyl] ester Formula: C16H13Cl2N5O3 MolecularWeight: 394.21212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=NN12)C(=O)OCC(=O)NC3=C(C=CC=C3Cl)Cl)C

Isomeric SMILES

CC1=CC(=NC2=NC(=NN12)C(=O)OCC(=O)NC3=C(C=CC=C3Cl)Cl)C

InChI

InChI=1S/C16H13Cl2N5O3/c1-8-6-9(2)23-16(19-8)21-14(22-23)15(25)26-7-12(24)20-13-10(17)4-3-5-11(13)18/h3-6H,7H2,1-2H3,(H,20,24)