octyl 7-(4-dimethylaminophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: octyl 7-(4-dimethylaminophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: octyl 7-(4-dimethylaminophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-(4-dimethylaminophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid octyl ester IUPAC Name: octyl 7-(4-dimethylaminophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-(4-dimethylaminophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid octyl ester Formula: C23H33N5O2 MolecularWeight: 411.54042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(N=C2N=CNN2C1C3=CC=C(C=C3)N(C)C)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(N=C2N=CNN2C1C3=CC=C(C=C3)N(C)C)C

InChI

InChI=1S/C23H33N5O2/c1-5-6-7-8-9-10-15-30-22(29)20-17(2)26-23-24-16-25-28(23)21(20)18-11-13-19(14-12-18)27(3)4/h11-14,16,21H,5-10,15H2,1-4H3,(H,24,25,26)