2-methyl-1-[4-[(E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[(E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[(E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enoyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[(E)-1-oxo-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]prop-2-enyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-[(E)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enoyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[(E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acryloyl]piperazino]propan-1-one Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)/C=C/C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5O2/c1-19(2)25(32)29-15-13-28(14-16-29)23(31)11-10-21-18-30(22-8-4-3-5-9-22)27-24(21)20-7-6-12-26-17-20/h3-12,17-19H,13-16H2,1-2H3/b11-10+