N-[4-[[4-(cyclohexylamino)-5-fluoranyl-pyrimidin-2-yl]amino]phenyl]benzamide

Systemtic Name: N-[4-[[4-(cyclohexylamino)-5-fluoranyl-pyrimidin-2-yl]amino]phenyl]benzamide Openeye Name: N-[4-[[4-(cyclohexylamino)-5-fluoro-pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: N-[4-[[4-(cyclohexylamino)-5-fluoro-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: N-[4-[[4-(cyclohexylamino)-5-fluoropyrimidin-2-yl]amino]phenyl]benzamide Traditional Name: N-[4-[[4-(cyclohexylamino)-5-fluoro-pyrimidin-2-yl]amino]phenyl]benzamide Formula: C23H24FN5O MolecularWeight: 405.467963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H24FN5O/c24-20-15-25-23(29-21(20)26-17-9-5-2-6-10-17)28-19-13-11-18(12-14-19)27-22(30)16-7-3-1-4-8-16/h1,3-4,7-8,11-15,17H,2,5-6,9-10H2,(H,27,30)(H2,25,26,28,29)