(phenylmethyl) 7-(4-hydroxyphenyl)-5-methyl-2-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 7-(4-hydroxyphenyl)-5-methyl-2-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: benzyl 7-(4-hydroxyphenyl)-5-methyl-2-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-(4-hydroxyphenyl)-5-methyl-2-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-(4-hydroxyphenyl)-5-methyl-2-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-(4-hydroxyphenyl)-5-methyl-2-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid benzyl ester Formula: C26H22N4O3 MolecularWeight: 438.47788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=N1)N=C(N2)C3=CC=CC=C3)C4=CC=C(C=C4)O)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(N2C(=N1)N=C(N2)C3=CC=CC=C3)C4=CC=C(C=C4)O)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C26H22N4O3/c1-17-22(25(32)33-16-18-8-4-2-5-9-18)23(19-12-14-21(31)15-13-19)30-26(27-17)28-24(29-30)20-10-6-3-7-11-20/h2-15,23,31H,16H2,1H3,(H,27,28,29)