N-methyl-N-[6-[[6-[(4-phenoxyphenyl)amino]pyrimidin-4-yl]amino]pyridin-2-yl]prop-2-enamide

Systemtic Name: N-methyl-N-[6-[[6-[(4-phenoxyphenyl)amino]pyrimidin-4-yl]amino]pyridin-2-yl]prop-2-enamide Openeye Name: N-methyl-N-[6-[[6-(4-phenoxyanilino)pyrimidin-4-yl]amino]-2-pyridyl]prop-2-enamide CAS Name: N-methyl-N-[6-[[6-(4-phenoxyanilino)-4-pyrimidinyl]amino]-2-pyridinyl]-2-propenamide IUPAC Name: N-methyl-N-[6-[[6-(4-phenoxyanilino)pyrimidin-4-yl]amino]pyridin-2-yl]prop-2-enamide Traditional Name: N-methyl-N-[6-[[6-(4-phenoxyanilino)pyrimidin-4-yl]amino]-2-pyridyl]acrylamide Formula: C25H22N6O2 MolecularWeight: 438.48118

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC(=N1)NC2=NC=NC(=C2)NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)C=C

Isomeric SMILES

CN(C1=CC=CC(=N1)NC2=NC=NC(=C2)NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)C=C

InChI

InChI=1S/C25H22N6O2/c1-3-25(32)31(2)24-11-7-10-21(30-24)29-23-16-22(26-17-27-23)28-18-12-14-20(15-13-18)33-19-8-5-4-6-9-19/h3-17H,1H2,2H3,(H2,26,27,28,29,30)