(E)-2-benzamido-3-(3-methyl-5-phenyl-1-pyridin-2-yl-pyrazol-4-yl)prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-(3-methyl-5-phenyl-1-pyridin-2-yl-pyrazol-4-yl)prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-[3-methyl-5-phenyl-1-(2-pyridyl)pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-2-benzamido-3-[3-methyl-5-phenyl-1-(2-pyridinyl)-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-(3-methyl-5-phenyl-1-pyridin-2-ylpyrazol-4-yl)prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-[3-methyl-5-phenyl-1-(2-pyridyl)pyrazol-4-yl]acrylic acid Formula: C25H20N4O3 MolecularWeight: 424.4513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C(=O)O)NC(=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

CC1=NN(C(=C1/C=C(\C(=O)O)/NC(=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C25H20N4O3/c1-17-20(16-21(25(31)32)27-24(30)19-12-6-3-7-13-19)23(18-10-4-2-5-11-18)29(28-17)22-14-8-9-15-26-22/h2-16H,1H3,(H,27,30)(H,31,32)/b21-16+