3-fluoranyl-N-[4-methyl-2,6-bis[(4-methylphenyl)amino]pyrimidin-5-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[4-methyl-2,6-bis[(4-methylphenyl)amino]pyrimidin-5-yl]benzamide Openeye Name: 3-fluoro-N-[4-methyl-2,6-bis(4-methylanilino)pyrimidin-5-yl]benzamide CAS Name: 3-fluoro-N-[4-methyl-2,6-bis(4-methylanilino)-5-pyrimidinyl]benzamide IUPAC Name: 3-fluoro-N-[4-methyl-2,6-bis(4-methylanilino)pyrimidin-5-yl]benzamide Traditional Name: 3-fluoro-N-[4-methyl-2,6-bis(p-toluidino)pyrimidin-5-yl]benzamide Formula: C26H24FN5O MolecularWeight: 441.500063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2NC(=O)C3=CC(=CC=C3)F)C)NC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2NC(=O)C3=CC(=CC=C3)F)C)NC4=CC=C(C=C4)C

InChI

InChI=1S/C26H24FN5O/c1-16-7-11-21(12-8-16)29-24-23(31-25(33)19-5-4-6-20(27)15-19)18(3)28-26(32-24)30-22-13-9-17(2)10-14-22/h4-15H,1-3H3,(H,31,33)(H2,28,29,30,32)