ethyl 4-[3,3-dimethylbutyl(pentan-2-yl)amino]-2-propyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[3,3-dimethylbutyl(pentan-2-yl)amino]-2-propyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3,3-dimethylbutyl(1-methylbutyl)amino]-2-propyl-pyrimidine-5-carboxylate CAS Name: 4-[3,3-dimethylbutyl(pentan-2-yl)amino]-2-propyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3,3-dimethylbutyl(pentan-2-yl)amino]-2-propylpyrimidine-5-carboxylate Traditional Name: 4-[3,3-dimethylbutyl(1-methylbutyl)amino]-2-propyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H37N3O2 MolecularWeight: 363.53738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C(=N1)N(CCC(C)(C)C)C(C)CCC)C(=O)OCC

Isomeric SMILES

CCCC1=NC=C(C(=N1)N(CCC(C)(C)C)C(C)CCC)C(=O)OCC

InChI

InChI=1S/C21H37N3O2/c1-8-11-16(4)24(14-13-21(5,6)7)19-17(20(25)26-10-3)15-22-18(23-19)12-9-2/h15-16H,8-14H2,1-7H3