N-[3-[(2-chloranylpyrimidin-4-yl)amino]-4-methyl-phenyl]-3-fluoranyl-5-morpholin-4-yl-benzamide

Systemtic Name: N-[3-[(2-chloranylpyrimidin-4-yl)amino]-4-methyl-phenyl]-3-fluoranyl-5-morpholin-4-yl-benzamide Openeye Name: N-[3-[(2-chloropyrimidin-4-yl)amino]-4-methyl-phenyl]-3-fluoro-5-morpholino-benzamide CAS Name: N-[3-[(2-chloro-4-pyrimidinyl)amino]-4-methylphenyl]-3-fluoro-5-(4-morpholinyl)benzamide IUPAC Name: N-[3-[(2-chloropyrimidin-4-yl)amino]-4-methylphenyl]-3-fluoro-5-morpholin-4-ylbenzamide Traditional Name: N-[3-[(2-chloropyrimidin-4-yl)amino]-4-methyl-phenyl]-3-fluoro-5-morpholino-benzamide Formula: C22H21ClFN5O2 MolecularWeight: 441.885843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)F)N3CCOCC3)NC4=NC(=NC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)F)N3CCOCC3)NC4=NC(=NC=C4)Cl

InChI

InChI=1S/C22H21ClFN5O2/c1-14-2-3-17(13-19(14)27-20-4-5-25-22(23)28-20)26-21(30)15-10-16(24)12-18(11-15)29-6-8-31-9-7-29/h2-5,10-13H,6-9H2,1H3,(H,26,30)(H,25,27,28)