ethyl 4-[(4-butoxyphenyl)-propyl-amino]-6-ethyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-butoxyphenyl)-propyl-amino]-6-ethyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-butoxy-N-propyl-anilino)-6-ethyl-pyrimidine-5-carboxylate CAS Name: 4-(4-butoxy-N-propylanilino)-6-ethyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butoxy-N-propylanilino)-6-ethylpyrimidine-5-carboxylate Traditional Name: 4-(4-butoxy-N-propyl-anilino)-6-ethyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(CCC)C2=NC=NC(=C2C(=O)OCC)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N(CCC)C2=NC=NC(=C2C(=O)OCC)CC

InChI

InChI=1S/C22H31N3O3/c1-5-9-15-28-18-12-10-17(11-13-18)25(14-6-2)21-20(22(26)27-8-4)19(7-3)23-16-24-21/h10-13,16H,5-9,14-15H2,1-4H3