(E)-3-(4-methoxyphenyl)-1-[4-(5-phenyl-2-pyridin-3-yl-pyrimidin-4-yl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-methoxyphenyl)-1-[4-(5-phenyl-2-pyridin-3-yl-pyrimidin-4-yl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-methoxyphenyl)-1-[4-[5-phenyl-2-(3-pyridyl)pyrimidin-4-yl]-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(4-methoxyphenyl)-1-[4-[5-phenyl-2-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-methoxyphenyl)-1-[4-(5-phenyl-2-pyridin-3-ylpyrimidin-4-yl)piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-methoxyphenyl)-1-[4-[5-phenyl-2-(3-pyridyl)pyrimidin-4-yl]piperidino]prop-2-en-1-one Formula: C30H28N4O2 MolecularWeight: 476.56892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)N2CCC(CC2)C3=NC(=NC=C3C4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)N2CCC(CC2)C3=NC(=NC=C3C4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C30H28N4O2/c1-36-26-12-9-22(10-13-26)11-14-28(35)34-18-15-24(16-19-34)29-27(23-6-3-2-4-7-23)21-32-30(33-29)25-8-5-17-31-20-25/h2-14,17,20-21,24H,15-16,18-19H2,1H3/b14-11+