ethyl 2-butyl-4-[[4-[2-(methylamino)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-butyl-4-[[4-[2-(methylamino)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-butyl-4-[[4-[2-(methylamino)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate CAS Name: 2-butyl-4-[[4-[2-(methylamino)phenyl]phenyl]methylamino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-4-[[4-[2-(methylamino)phenyl]phenyl]methylamino]pyrimidine-5-carboxylate Traditional Name: 2-butyl-4-[[4-[2-(methylamino)phenyl]benzyl]amino]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)NCC2=CC=C(C=C2)C3=CC=CC=C3NC)C(=O)OCC

Isomeric SMILES

CCCCC1=NC=C(C(=N1)NCC2=CC=C(C=C2)C3=CC=CC=C3NC)C(=O)OCC

InChI

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