N-[4-chloranyl-6-(2-cyanoethylamino)pyrimidin-5-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[4-chloranyl-6-(2-cyanoethylamino)pyrimidin-5-yl]-3-fluoranyl-benzamide Openeye Name: N-[4-chloro-6-(2-cyanoethylamino)pyrimidin-5-yl]-3-fluoro-benzamide CAS Name: N-[4-chloro-6-(2-cyanoethylamino)-5-pyrimidinyl]-3-fluorobenzamide IUPAC Name: N-[4-chloro-6-(2-cyanoethylamino)pyrimidin-5-yl]-3-fluorobenzamide Traditional Name: N-[4-chloro-6-(2-cyanoethylamino)pyrimidin-5-yl]-3-fluoro-benzamide Formula: C14H11ClFN5O MolecularWeight: 319.721443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C(=O)NC2=C(N=CN=C2Cl)NCCC#N

Isomeric SMILES

C1=CC(=CC(=C1)F)C(=O)NC2=C(N=CN=C2Cl)NCCC#N

InChI

InChI=1S/C14H11ClFN5O/c15-12-11(13(20-8-19-12)18-6-2-5-17)21-14(22)9-3-1-4-10(16)7-9/h1,3-4,7-8H,2,6H2,(H,21,22)(H,18,19,20)