(E)-3-(3,4-dimethoxyphenyl)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(6-piperidinopyrimidin-4-yl)piperazino]prop-2-en-1-one Formula: C24H31N5O3 MolecularWeight: 437.53464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4)OC

InChI

InChI=1S/C24H31N5O3/c1-31-20-8-6-19(16-21(20)32-2)7-9-24(30)29-14-12-28(13-15-29)23-17-22(25-18-26-23)27-10-4-3-5-11-27/h6-9,16-18H,3-5,10-15H2,1-2H3/b9-7+