N-[[1-(2-azanyl-6-propan-2-yl-pyrimidin-4-yl)carbonylpiperidin-3-yl]methyl]-4-fluoranyl-benzamide

Systemtic Name: N-[[1-(2-azanyl-6-propan-2-yl-pyrimidin-4-yl)carbonylpiperidin-3-yl]methyl]-4-fluoranyl-benzamide Openeye Name: N-[[1-(2-amino-6-isopropyl-pyrimidine-4-carbonyl)-3-piperidyl]methyl]-4-fluoro-benzamide CAS Name: N-[[1-[(2-amino-6-propan-2-yl-4-pyrimidinyl)-oxomethyl]-3-piperidinyl]methyl]-4-fluorobenzamide IUPAC Name: N-[[1-(2-amino-6-propan-2-ylpyrimidine-4-carbonyl)piperidin-3-yl]methyl]-4-fluorobenzamide Traditional Name: N-[[1-(2-amino-6-isopropyl-pyrimidine-4-carbonyl)-3-piperidyl]methyl]-4-fluoro-benzamide Formula: C21H26FN5O2 MolecularWeight: 399.461843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C(=O)N2CCCC(C2)CNC(=O)C3=CC=C(C=C3)F)N

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C(=O)N2CCCC(C2)CNC(=O)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C21H26FN5O2/c1-13(2)17-10-18(26-21(23)25-17)20(29)27-9-3-4-14(12-27)11-24-19(28)15-5-7-16(22)8-6-15/h5-8,10,13-14H,3-4,9,11-12H2,1-2H3,(H,24,28)(H2,23,25,26)