tert-butyl 2-[[2-(2,3-dihydroindol-1-yl)-4-ethoxy-pyrimidin-5-yl]carbonylamino]ethanoate

Systemtic Name: tert-butyl 2-[[2-(2,3-dihydroindol-1-yl)-4-ethoxy-pyrimidin-5-yl]carbonylamino]ethanoate Openeye Name: tert-butyl 2-[(4-ethoxy-2-indolin-1-yl-pyrimidine-5-carbonyl)amino]acetate CAS Name: 2-[[[2-(2,3-dihydroindol-1-yl)-4-ethoxy-5-pyrimidinyl]-oxomethyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-(2,3-dihydroindol-1-yl)-4-ethoxypyrimidine-5-carbonyl]amino]acetate Traditional Name: 2-[(4-ethoxy-2-indolin-1-yl-pyrimidine-5-carbonyl)amino]acetic acid tert-butyl ester Formula: C21H26N4O4 MolecularWeight: 398.45554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC=C1C(=O)NCC(=O)OC(C)(C)C)N2CCC3=CC=CC=C32

Isomeric SMILES

CCOC1=NC(=NC=C1C(=O)NCC(=O)OC(C)(C)C)N2CCC3=CC=CC=C32

InChI

InChI=1S/C21H26N4O4/c1-5-28-19-15(18(27)22-13-17(26)29-21(2,3)4)12-23-20(24-19)25-11-10-14-8-6-7-9-16(14)25/h6-9,12H,5,10-11,13H2,1-4H3,(H,22,27)