ethyl 4-[2-(2-azanylpyrimidin-4-yl)-5-(4-fluorophenyl)-3-(1-methylpiperidin-4-yl)-2H-imidazol-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2-azanylpyrimidin-4-yl)-5-(4-fluorophenyl)-3-(1-methylpiperidin-4-yl)-2H-imidazol-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[2-(2-aminopyrimidin-4-yl)-5-(4-fluorophenyl)-3-(1-methyl-4-piperidyl)-2H-imidazol-1-yl]piperidine-1-carboxylate CAS Name: 4-[2-(2-amino-4-pyrimidinyl)-5-(4-fluorophenyl)-3-(1-methyl-4-piperidinyl)-2H-imidazol-1-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-aminopyrimidin-4-yl)-5-(4-fluorophenyl)-3-(1-methylpiperidin-4-yl)-2H-imidazol-1-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(2-aminopyrimidin-4-yl)-5-(4-fluorophenyl)-3-(1-methyl-4-piperidyl)-4-imidazolin-1-yl]piperidine-1-carboxylic acid ethyl ester Formula: C27H36FN7O2 MolecularWeight: 509.618843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(N(C=C2C3=CC=C(C=C3)F)C4CCN(CC4)C)C5=NC(=NC=C5)N

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(N(C=C2C3=CC=C(C=C3)F)C4CCN(CC4)C)C5=NC(=NC=C5)N

InChI

InChI=1S/C27H36FN7O2/c1-3-37-27(36)33-16-11-22(12-17-33)35-24(19-4-6-20(28)7-5-19)18-34(21-9-14-32(2)15-10-21)25(35)23-8-13-30-26(29)31-23/h4-8,13,18,21-22,25H,3,9-12,14-17H2,1-2H3,(H2,29,30,31)