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

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)-5-methyl-pyrimidin-4-yl]amino]ethyl]-3-methyl-2-oxidanyl-benzamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)-5-methyl-pyrimidin-4-yl]amino]ethyl]-2-hydroxy-3-methyl-benzamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)-5-methyl-4-pyrimidinyl]amino]ethyl]-2-hydroxy-3-methylbenzamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)-5-methylpyrimidin-4-yl]amino]ethyl]-2-hydroxy-3-methylbenzamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)-5-methyl-pyrimidin-4-yl]amino]ethyl]-2-hydroxy-3-methyl-benzamide Formula: C25H29ClN6O3 MolecularWeight: 496.98916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)NCCNC2=C(C(=NC(=N2)C3=CC=C(C=C3)Cl)NCCNC(=O)C)C

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)NCCNC2=C(C(=NC(=N2)C3=CC=C(C=C3)Cl)NCCNC(=O)C)C

InChI

InChI=1S/C25H29ClN6O3/c1-15-5-4-6-20(21(15)34)25(35)30-14-13-29-23-16(2)22(28-12-11-27-17(3)33)31-24(32-23)18-7-9-19(26)10-8-18/h4-10,34H,11-14H2,1-3H3,(H,27,33)(H,30,35)(H2,28,29,31,32)