3-chloranyl-4-fluoranyl-N-[4-[[4-(methylamino)pyrimidin-2-yl]amino]cyclohexyl]benzamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[4-[[4-(methylamino)pyrimidin-2-yl]amino]cyclohexyl]benzamide Openeye Name: 3-chloro-4-fluoro-N-[4-[[4-(methylamino)pyrimidin-2-yl]amino]cyclohexyl]benzamide CAS Name: 3-chloro-4-fluoro-N-[4-[[4-(methylamino)-2-pyrimidinyl]amino]cyclohexyl]benzamide IUPAC Name: 3-chloro-4-fluoro-N-[4-[[4-(methylamino)pyrimidin-2-yl]amino]cyclohexyl]benzamide Traditional Name: 3-chloro-4-fluoro-N-[4-[[4-(methylamino)pyrimidin-2-yl]amino]cyclohexyl]benzamide Formula: C18H21ClFN5O MolecularWeight: 377.843643

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CNC1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H21ClFN5O/c1-21-16-8-9-22-18(25-16)24-13-5-3-12(4-6-13)23-17(26)11-2-7-15(20)14(19)10-11/h2,7-10,12-13H,3-6H2,1H3,(H,23,26)(H2,21,22,24,25)