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

Systemtic Name: ethyl 7-(4-butoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 7-(4-butoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-(4-butoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 7-(4-butoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-(4-butoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)OCC

InChI

InChI=1S/C19H24N4O3/c1-4-6-11-26-15-9-7-14(8-10-15)17-16(18(24)25-5-2)13(3)22-19-20-12-21-23(17)19/h7-10,12,17H,4-6,11H2,1-3H3,(H,20,21,22)