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

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-4-methyl-3-oxidanyl-benzamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-hydroxy-4-methyl-benzamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]amino]ethyl]-3-hydroxy-4-methylbenzamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]amino]ethyl]-3-hydroxy-4-methylbenzamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-hydroxy-4-methyl-benzamide Formula: C24H28N6O3 MolecularWeight: 448.51752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N6O3/c1-16-8-9-19(14-20(16)32)24(33)28-13-12-27-22-15-21(26-11-10-25-17(2)31)29-23(30-22)18-6-4-3-5-7-18/h3-9,14-15,32H,10-13H2,1-2H3,(H,25,31)(H,28,33)(H2,26,27,29,30)