2-chloranyl-N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-5-fluoranyl-pyrimidin-4-amine

Systemtic Name: 2-chloranyl-N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-5-fluoranyl-pyrimidin-4-amine Openeye Name: 2-chloro-N-[1-[(4-chloro-3,5-diethoxy-phenyl)methyl]-4-piperidyl]-5-fluoro-pyrimidin-4-amine CAS Name: 2-chloro-N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]-4-piperidinyl]-5-fluoro-4-pyrimidinamine IUPAC Name: 2-chloro-N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]piperidin-4-yl]-5-fluoropyrimidin-4-amine Traditional Name: [1-(4-chloro-3,5-diethoxy-benzyl)-4-piperidyl]-(2-chloro-5-fluoro-pyrimidin-4-yl)amine Formula: C20H25Cl2FN4O2 MolecularWeight: 443.342503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC(=NC=C3F)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC(=NC=C3F)Cl

InChI

InChI=1S/C20H25Cl2FN4O2/c1-3-28-16-9-13(10-17(18(16)21)29-4-2)12-27-7-5-14(6-8-27)25-19-15(23)11-24-20(22)26-19/h9-11,14H,3-8,12H2,1-2H3,(H,24,25,26)