ethyl 4-[1-[4-(2-aminophenyl)phenyl]ethylamino]-2-butyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[1-[4-(2-aminophenyl)phenyl]ethylamino]-2-butyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[1-[4-(2-aminophenyl)phenyl]ethylamino]-2-butyl-pyrimidine-5-carboxylate CAS Name: 4-[1-[4-(2-aminophenyl)phenyl]ethylamino]-2-butyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[4-(2-aminophenyl)phenyl]ethylamino]-2-butylpyrimidine-5-carboxylate Traditional Name: 4-[1-[4-(2-aminophenyl)phenyl]ethylamino]-2-butyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(C(=N1)NC(C)C2=CC=C(C=C2)C3=CC=CC=C3N)C(=O)OCC

Isomeric SMILES

CCCCC1=NC=C(C(=N1)NC(C)C2=CC=C(C=C2)C3=CC=CC=C3N)C(=O)OCC

InChI

InChI=1S/C25H30N4O2/c1-4-6-11-23-27-16-21(25(30)31-5-2)24(29-23)28-17(3)18-12-14-19(15-13-18)20-9-7-8-10-22(20)26/h7-10,12-17H,4-6,11,26H2,1-3H3,(H,27,28,29)