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

Systemtic Name: 3-[[(E)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enoyl]amino]benzamide Openeye Name: 3-[[(E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enoyl]amino]benzamide CAS Name: 3-[[(E)-1-oxo-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]prop-2-enyl]amino]benzamide IUPAC Name: 3-[[(E)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enoyl]amino]benzamide Traditional Name: 3-[[(E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]acryloyl]amino]benzamide Formula: C25H21N5O2 MolecularWeight: 423.46654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)C=CC(=O)NC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)/C=C/C(=O)NC4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C25H21N5O2/c26-25(32)19-8-4-10-22(14-19)28-23(31)12-11-21-17-30(16-18-6-2-1-3-7-18)29-24(21)20-9-5-13-27-15-20/h1-15,17H,16H2,(H2,26,32)(H,28,31)/b12-11+