3-(2,4-dimethoxypyrimidin-5-yl)-1-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one Openeye Name: 1-[4-[1-(4-benzyloxybutyl)imidazol-2-yl]-1-piperidyl]-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-en-1-one CAS Name: 3-(2,4-dimethoxy-5-pyrimidinyl)-1-[4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinyl]-2-propen-1-one IUPAC Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one Traditional Name: 1-[4-[1-(4-benzoxybutyl)imidazol-2-yl]piperidino]-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-en-1-one Formula: C28H35N5O4 MolecularWeight: 505.6086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C=CC(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=NC(=NC=C1C=CC(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4)OC

InChI

InChI=1S/C28H35N5O4/c1-35-27-24(20-30-28(31-27)36-2)10-11-25(34)32-16-12-23(13-17-32)26-29-14-18-33(26)15-6-7-19-37-21-22-8-4-3-5-9-22/h3-5,8-11,14,18,20,23H,6-7,12-13,15-17,19,21H2,1-2H3