4-(4-chloranyl-2-imidazol-1-yl-1H-pyrimidin-4-yl)-N-[(4-methoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)piperazine-2-carboxamide

Systemtic Name: 4-(4-chloranyl-2-imidazol-1-yl-1H-pyrimidin-4-yl)-N-[(4-methoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)piperazine-2-carboxamide Openeye Name: 4-(4-chloro-2-imidazol-1-yl-1H-pyrimidin-4-yl)-N-[(4-methoxyphenyl)methyl]-1-(3-pyridylmethyl)piperazine-2-carboxamide CAS Name: 4-[4-chloro-2-(1-imidazolyl)-1H-pyrimidin-4-yl]-N-[(4-methoxyphenyl)methyl]-1-(3-pyridinylmethyl)-2-piperazinecarboxamide IUPAC Name: 4-(4-chloro-2-imidazol-1-yl-1H-pyrimidin-4-yl)-N-[(4-methoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)piperazine-2-carboxamide Traditional Name: 4-(4-chloro-2-imidazol-1-yl-1H-pyrimidin-4-yl)-N-p-anisyl-1-(3-pyridylmethyl)piperazine-2-carboxamide Formula: C26H29ClN8O2 MolecularWeight: 521.01386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2CN(CCN2CC3=CN=CC=C3)C4(C=CNC(=N4)N5C=CN=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2CN(CCN2CC3=CN=CC=C3)C4(C=CNC(=N4)N5C=CN=C5)Cl

InChI

InChI=1S/C26H29ClN8O2/c1-37-22-6-4-20(5-7-22)16-31-24(36)23-18-35(14-13-33(23)17-21-3-2-9-28-15-21)26(27)8-10-30-25(32-26)34-12-11-29-19-34/h2-12,15,19,23H,13-14,16-18H2,1H3,(H,30,32)(H,31,36)