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

Systemtic Name: N-[4-[[4-(cyclobutylamino)-5-fluoranyl-pyrimidin-2-yl]amino]phenyl]benzamide Openeye Name: N-[4-[[4-(cyclobutylamino)-5-fluoro-pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: N-[4-[[4-(cyclobutylamino)-5-fluoro-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: N-[4-[[4-(cyclobutylamino)-5-fluoropyrimidin-2-yl]amino]phenyl]benzamide Traditional Name: N-[4-[[4-(cyclobutylamino)-5-fluoro-pyrimidin-2-yl]amino]phenyl]benzamide Formula: C21H20FN5O MolecularWeight: 377.414803

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(C1)NC2=NC(=NC=C2F)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20FN5O/c22-18-13-23-21(27-19(18)24-15-7-4-8-15)26-17-11-9-16(10-12-17)25-20(28)14-5-2-1-3-6-14/h1-3,5-6,9-13,15H,4,7-8H2,(H,25,28)(H2,23,24,26,27)