(E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)-1-(4-piperidin-1-ylcarbonylpiperidin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)-1-(4-piperidin-1-ylcarbonylpiperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]-1-[4-(piperidine-1-carbonyl)-1-piperidyl]prop-2-en-1-one CAS Name: (E)-1-[4-[oxo(1-piperidinyl)methyl]-1-piperidinyl]-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)-1-[4-(piperidine-1-carbonyl)piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]-1-[4-(piperidine-1-carbonyl)piperidino]prop-2-en-1-one Formula: C28H31N5O2 MolecularWeight: 469.57804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)C=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)/C=C/C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H31N5O2/c34-26(31-18-13-22(14-19-31)28(35)32-16-5-2-6-17-32)12-11-24-21-33(25-9-3-1-4-10-25)30-27(24)23-8-7-15-29-20-23/h1,3-4,7-12,15,20-22H,2,5-6,13-14,16-19H2/b12-11+