(E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-phenyl-but-3-enamide

Systemtic Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-phenyl-but-3-enamide Openeye Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-phenyl-but-3-enamide CAS Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]amino]ethyl]-4-phenyl-3-butenamide IUPAC Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]amino]ethyl]-4-phenylbut-3-enamide Traditional Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-phenyl-but-3-enamide Formula: C26H30N6O2 MolecularWeight: 458.5554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=CC(=NC(=N1)C2=CC=CC=C2)NCCNC(=O)CC=CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC1=CC(=NC(=N1)C2=CC=CC=C2)NCCNC(=O)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H30N6O2/c1-20(33)27-15-16-28-23-19-24(32-26(31-23)22-12-6-3-7-13-22)29-17-18-30-25(34)14-8-11-21-9-4-2-5-10-21/h2-13,19H,14-18H2,1H3,(H,27,33)(H,30,34)(H2,28,29,31,32)/b11-8+