(phenylmethyl) 4-cyclohexyl-6-methyl-2-pyrazol-1-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 4-cyclohexyl-6-methyl-2-pyrazol-1-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: benzyl 4-cyclohexyl-6-methyl-2-pyrazol-1-yl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-cyclohexyl-6-methyl-2-(1-pyrazolyl)-1,4-dihydropyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-cyclohexyl-6-methyl-2-pyrazol-1-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-cyclohexyl-6-methyl-2-pyrazol-1-yl-1,4-dihydropyrimidine-5-carboxylic acid benzyl ester Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)N2C=CC=N2)C3CCCCC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(N=C(N1)N2C=CC=N2)C3CCCCC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O2/c1-16-19(21(27)28-15-17-9-4-2-5-10-17)20(18-11-6-3-7-12-18)25-22(24-16)26-14-8-13-23-26/h2,4-5,8-10,13-14,18,20H,3,6-7,11-12,15H2,1H3,(H,24,25)