N-[3-[[5-fluoranyl-4-[(3-methylphenyl)amino]pyrimidin-2-yl]amino]phenyl]prop-2-enamide

Systemtic Name: N-[3-[[5-fluoranyl-4-[(3-methylphenyl)amino]pyrimidin-2-yl]amino]phenyl]prop-2-enamide Openeye Name: N-[3-[[5-fluoro-4-(3-methylanilino)pyrimidin-2-yl]amino]phenyl]prop-2-enamide CAS Name: N-[3-[[5-fluoro-4-(3-methylanilino)-2-pyrimidinyl]amino]phenyl]-2-propenamide IUPAC Name: N-[3-[[5-fluoro-4-(3-methylanilino)pyrimidin-2-yl]amino]phenyl]prop-2-enamide Traditional Name: N-[3-[[5-fluoro-4-(m-toluidino)pyrimidin-2-yl]amino]phenyl]acrylamide Formula: C20H18FN5O MolecularWeight: 363.388223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC=C2F)NC3=CC(=CC=C3)NC(=O)C=C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC=C2F)NC3=CC(=CC=C3)NC(=O)C=C

InChI

InChI=1S/C20H18FN5O/c1-3-18(27)23-15-8-5-9-16(11-15)25-20-22-12-17(21)19(26-20)24-14-7-4-6-13(2)10-14/h3-12H,1H2,2H3,(H,23,27)(H2,22,24,25,26)