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

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-bromanyl-3-methyl-benzamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-bromo-3-methyl-benzamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]amino]ethyl]-4-bromo-3-methylbenzamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]amino]ethyl]-4-bromo-3-methylbenzamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-bromo-3-methyl-benzamide Formula: C24H27BrN6O2 MolecularWeight: 511.41418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27BrN6O2/c1-16-14-19(8-9-20(16)25)24(33)29-13-12-28-22-15-21(27-11-10-26-17(2)32)30-23(31-22)18-6-4-3-5-7-18/h3-9,14-15H,10-13H2,1-2H3,(H,26,32)(H,29,33)(H2,27,28,30,31)