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

Systemtic Name: N-[4-[[4-(cyclopentylamino)-5-fluoranyl-pyrimidin-2-yl]amino]phenyl]benzamide Openeye Name: N-[4-[[4-(cyclopentylamino)-5-fluoro-pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: N-[4-[[4-(cyclopentylamino)-5-fluoro-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: N-[4-[[4-(cyclopentylamino)-5-fluoropyrimidin-2-yl]amino]phenyl]benzamide Traditional Name: N-[4-[[4-(cyclopentylamino)-5-fluoro-pyrimidin-2-yl]amino]phenyl]benzamide Formula: C22H22FN5O MolecularWeight: 391.441383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22FN5O/c23-19-14-24-22(28-20(19)25-16-8-4-5-9-16)27-18-12-10-17(11-13-18)26-21(29)15-6-2-1-3-7-15/h1-3,6-7,10-14,16H,4-5,8-9H2,(H,26,29)(H2,24,25,27,28)