N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-bromanyl-3-methyl-benzamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-bromanyl-3-methyl-benzamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-bromo-3-methyl-benzamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-4-bromo-3-methylbenzamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-4-bromo-3-methylbenzamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-bromo-3-methyl-benzamide Formula: C25H29BrN6O2 MolecularWeight: 525.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCNC2=C(C(=NC(=N2)C3=CC=CC=C3)NCCNC(=O)C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCNC2=C(C(=NC(=N2)C3=CC=CC=C3)NCCNC(=O)C)C)Br

InChI

InChI=1S/C25H29BrN6O2/c1-16-15-20(9-10-21(16)26)25(34)30-14-13-29-23-17(2)22(28-12-11-27-18(3)33)31-24(32-23)19-7-5-4-6-8-19/h4-10,15H,11-14H2,1-3H3,(H,27,33)(H,30,34)(H2,28,29,31,32)