4-[[(E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]amino]benzamide

Systemtic Name: 4-[[(E)-3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]amino]benzamide Openeye Name: 4-[[(E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]amino]benzamide CAS Name: 4-[[(E)-3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enyl]amino]benzamide IUPAC Name: 4-[[(E)-3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]prop-2-enoyl]amino]benzamide Traditional Name: 4-[[(E)-3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]acryloyl]amino]benzamide Formula: C27H20N4O3 MolecularWeight: 448.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=CC(=O)NC5=CC=C(C=C5)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)/C=C/C(=O)NC5=CC=C(C=C5)C(=O)N

InChI

InChI=1S/C27H20N4O3/c28-27(33)18-10-13-21(14-11-18)29-25(32)15-12-20-17-31(22-7-2-1-3-8-22)30-26(20)24-16-19-6-4-5-9-23(19)34-24/h1-17H,(H2,28,33)(H,29,32)/b15-12+