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

Systemtic Name: 3-fluoranyl-N-[4-methyl-3-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]-5-morpholin-4-yl-benzamide Openeye Name: 3-fluoro-N-[4-methyl-3-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]-5-morpholino-benzamide CAS Name: 3-fluoro-N-[4-methyl-3-[[2-(methylthio)-4-pyrimidinyl]amino]phenyl]-5-(4-morpholinyl)benzamide IUPAC Name: 3-fluoro-N-[4-methyl-3-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]-5-morpholin-4-ylbenzamide Traditional Name: 3-fluoro-N-[4-methyl-3-[[2-(methylthio)pyrimidin-4-yl]amino]phenyl]-5-morpholino-benzamide Formula: C23H24FN5O2S MolecularWeight: 453.532363

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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)SC

Isomeric SMILES

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

InChI

InChI=1S/C23H24FN5O2S/c1-15-3-4-18(14-20(15)27-21-5-6-25-23(28-21)32-2)26-22(30)16-11-17(24)13-19(12-16)29-7-9-31-10-8-29/h3-6,11-14H,7-10H2,1-2H3,(H,26,30)(H,25,27,28)