(E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-pyridin-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-pyridin-2-yl-prop-2-enamide Openeye Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-(2-pyridyl)prop-2-enamide CAS Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-3-(2-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-3-pyridin-2-ylprop-2-enamide Traditional Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-(2-pyridyl)acrylamide Formula: C25H29N7O2 MolecularWeight: 459.54346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)C=CC3=CC=CC=N3

Isomeric SMILES

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)/C=C/C3=CC=CC=N3

InChI

InChI=1S/C25H29N7O2/c1-18-23(29-16-14-26-19(2)33)31-25(20-8-4-3-5-9-20)32-24(18)30-17-15-28-22(34)12-11-21-10-6-7-13-27-21/h3-13H,14-17H2,1-2H3,(H,26,33)(H,28,34)(H2,29,30,31,32)/b12-11+