ethyl 2-[(3,5-ditert-butylphenyl)amino]-3-ethyl-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[(3,5-ditert-butylphenyl)amino]-3-ethyl-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(3,5-ditert-butylanilino)-3-ethyl-4H-pyrimidine-5-carboxylate CAS Name: 2-(3,5-ditert-butylanilino)-3-ethyl-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,5-ditert-butylanilino)-3-ethyl-4H-pyrimidine-5-carboxylate Traditional Name: 2-(3,5-ditert-butylanilino)-3-ethyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H35N3O2 MolecularWeight: 385.5429

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(=CN=C1NC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCN1CC(=CN=C1NC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C23H35N3O2/c1-9-26-15-16(20(27)28-10-2)14-24-21(26)25-19-12-17(22(3,4)5)11-18(13-19)23(6,7)8/h11-14H,9-10,15H2,1-8H3,(H,24,25)