ethyl 3-(3,5-ditert-butylphenyl)-2-(propylamino)-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(3,5-ditert-butylphenyl)-2-(propylamino)-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 3-(3,5-ditert-butylphenyl)-2-(propylamino)-4H-pyrimidine-5-carboxylate CAS Name: 3-(3,5-ditert-butylphenyl)-2-(propylamino)-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3,5-ditert-butylphenyl)-2-(propylamino)-4H-pyrimidine-5-carboxylate Traditional Name: 3-(3,5-ditert-butylphenyl)-2-(propylamino)-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H37N3O2 MolecularWeight: 399.56948

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=C(CN1C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCNC1=NC=C(CN1C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C24H37N3O2/c1-9-11-25-22-26-15-17(21(28)29-10-2)16-27(22)20-13-18(23(3,4)5)12-19(14-20)24(6,7)8/h12-15H,9-11,16H2,1-8H3,(H,25,26)