prop-2-enyl 4-(cyclohexylcarbamoyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl 4-(cyclohexylcarbamoyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: allyl 4-(cyclohexylcarbamoyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[(cyclohexylamino)-oxomethyl]-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-(cyclohexylcarbamoyl)-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(cyclohexylcarbamoyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid allyl ester Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)OCC=C)C(=O)NC2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)OCC=C)C(=O)NC2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3/c1-3-14-28-22(27)18-15(2)23-20(16-10-6-4-7-11-16)25-19(18)21(26)24-17-12-8-5-9-13-17/h3-4,6-7,10-11,17H,1,5,8-9,12-14H2,2H3,(H,24,26)