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

Systemtic Name: ethyl 2-(2,3-dihydroindol-1-yl)-4-[(3-fluorophenyl)methylamino]pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(3-fluorophenyl)methylamino]-2-indolin-1-yl-pyrimidine-5-carboxylate CAS Name: 2-(2,3-dihydroindol-1-yl)-4-[(3-fluorophenyl)methylamino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,3-dihydroindol-1-yl)-4-[(3-fluorophenyl)methylamino]pyrimidine-5-carboxylate Traditional Name: 4-[(3-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(=CC=C2)F)N3CCC4=CC=CC=C43

Isomeric SMILES

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

InChI

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