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

Systemtic Name: (E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-1-(4-piperidin-1-ylcarbonylpiperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-[1-phenyl-3-(2-thienyl)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-thiophen-2-yl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)-1-[4-(piperidine-1-carbonyl)piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-1-[4-(piperidine-1-carbonyl)piperidino]prop-2-en-1-one Formula: C27H30N4O2S MolecularWeight: 474.6177

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)C=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)/C=C/C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C27H30N4O2S/c32-25(29-17-13-21(14-18-29)27(33)30-15-5-2-6-16-30)12-11-22-20-31(23-8-3-1-4-9-23)28-26(22)24-10-7-19-34-24/h1,3-4,7-12,19-21H,2,5-6,13-18H2/b12-11+