4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-N1-cyclohexyl-N2-[(2,3-dimethoxyphenyl)methyl]piperazine-1,2-dicarboxamide

Systemtic Name: 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-N1-cyclohexyl-N2-[(2,3-dimethoxyphenyl)methyl]piperazine-1,2-dicarboxamide Openeye Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-N1-cyclohexyl-N2-[(2,3-dimethoxyphenyl)methyl]piperazine-1,2-dicarboxamide CAS Name: 4-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-N1-cyclohexyl-N2-[(2,3-dimethoxyphenyl)methyl]piperazine-1,2-dicarboxamide IUPAC Name: 4-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-1-N-cyclohexyl-2-N-[(2,3-dimethoxyphenyl)methyl]piperazine-1,2-dicarboxamide Traditional Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-N-cyclohexyl-N'-o-veratryl-piperazine-1,2-dicarboxamide Formula: C28H35ClN8O4 MolecularWeight: 583.0817

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CNC(=O)C2CN(CCN2C(=O)NC3CCCCC3)C4=CC(=NC(=N4)N5C=CN=C5)Cl

Isomeric SMILES

COC1=CC=CC(=C1OC)CNC(=O)C2CN(CCN2C(=O)NC3CCCCC3)C4=CC(=NC(=N4)N5C=CN=C5)Cl

InChI

InChI=1S/C28H35ClN8O4/c1-40-22-10-6-7-19(25(22)41-2)16-31-26(38)21-17-35(13-14-37(21)28(39)32-20-8-4-3-5-9-20)24-15-23(29)33-27(34-24)36-12-11-30-18-36/h6-7,10-12,15,18,20-21H,3-5,8-9,13-14,16-17H2,1-2H3,(H,31,38)(H,32,39)