phenethyl 7-(3-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 7-(3-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: phenethyl 7-(3-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-(3-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid phenethyl ester IUPAC Name: phenethyl 7-(3-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-(3-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid phenethyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=N1)N=CN2)C3=CC(=CC=C3)OC)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(N2C(=N1)N=CN2)C3=CC(=CC=C3)OC)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O3/c1-15-19(21(27)29-12-11-16-7-4-3-5-8-16)20(26-22(25-15)23-14-24-26)17-9-6-10-18(13-17)28-2/h3-10,13-14,20H,11-12H2,1-2H3,(H,23,24,25)