ethyl 2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methylamino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methylamino]pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(4-fluorophenyl)methylamino]-2-indolin-1-yl-pyrimidine-5-carboxylate CAS Name: 2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methylamino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methylamino]pyrimidine-5-carboxylate Traditional Name: 4-[(4-fluorobenzyl)amino]-2-indolin-1-yl-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H21FN4O2 MolecularWeight: 392.426143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCC2=CC=C(C=C2)F)N3CCC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCC2=CC=C(C=C2)F)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H21FN4O2/c1-2-29-21(28)18-14-25-22(27-12-11-16-5-3-4-6-19(16)27)26-20(18)24-13-15-7-9-17(23)10-8-15/h3-10,14H,2,11-13H2,1H3,(H,24,25,26)