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

Systemtic Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one Openeye Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[4-[1-[2-(3-thienyl)ethyl]imidazol-2-yl]-1-piperidyl]prop-2-en-1-one CAS Name: 3-(2,4-dimethoxy-5-pyrimidinyl)-1-[4-[1-[2-(3-thiophenyl)ethyl]-2-imidazolyl]-1-piperidinyl]-2-propen-1-one IUPAC Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[4-[1-(2-thiophen-3-ylethyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one Traditional Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[4-[1-[2-(3-thienyl)ethyl]imidazol-2-yl]piperidino]prop-2-en-1-one Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C=CC(=O)N2CCC(CC2)C3=NC=CN3CCC4=CSC=C4)OC

Isomeric SMILES

COC1=NC(=NC=C1C=CC(=O)N2CCC(CC2)C3=NC=CN3CCC4=CSC=C4)OC

InChI

InChI=1S/C23H27N5O3S/c1-30-22-19(15-25-23(26-22)31-2)3-4-20(29)27-11-6-18(7-12-27)21-24-9-13-28(21)10-5-17-8-14-32-16-17/h3-4,8-9,13-16,18H,5-7,10-12H2,1-2H3