N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-[2-(1-imidazolyl)-4-pyrimidinyl]-2-piperidinyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]acetamide Traditional Name: N-homoveratryl-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]acetamide Formula: C24H30N6O3 MolecularWeight: 450.5334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CC2CCCCN2C3=NC(=NC=C3)N4C=CN=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CC2CCCCN2C3=NC(=NC=C3)N4C=CN=C4)OC

InChI

InChI=1S/C24H30N6O3/c1-32-20-7-6-18(15-21(20)33-2)8-10-26-23(31)16-19-5-3-4-13-30(19)22-9-11-27-24(28-22)29-14-12-25-17-29/h6-7,9,11-12,14-15,17,19H,3-5,8,10,13,16H2,1-2H3,(H,26,31)