N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]ethanamide

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]ethanamide Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]acetamide CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-[1-[2-(1-imidazolyl)-4-pyrimidinyl]-2-piperidinyl]acetamide IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]acetamide Traditional Name: N-(3-chloro-4-methoxy-benzyl)-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]acetamide Formula: C22H25ClN6O2 MolecularWeight: 440.9259

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CC2CCCCN2C3=NC(=NC=C3)N4C=CN=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CC2CCCCN2C3=NC(=NC=C3)N4C=CN=C4)Cl

InChI

InChI=1S/C22H25ClN6O2/c1-31-19-6-5-16(12-18(19)23)14-26-21(30)13-17-4-2-3-10-29(17)20-7-8-25-22(27-20)28-11-9-24-15-28/h5-9,11-12,15,17H,2-4,10,13-14H2,1H3,(H,26,30)