4-[2-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]acetyl]amino]benzamide CAS Name: 4-[[1-oxo-2-[3-[3-(5-pyrimidinyl)phenyl]-1-pyrazolyl]ethyl]amino]benzamide IUPAC Name: 4-[[2-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[3-[3-(5-pyrimidyl)phenyl]pyrazol-1-yl]acetyl]amino]benzamide Formula: C22H18N6O2 MolecularWeight: 398.41732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=NN(C=C2)CC(=O)NC3=CC=C(C=C3)C(=O)N)C4=CN=CN=C4

Isomeric SMILES

C1=CC(=CC(=C1)C2=NN(C=C2)CC(=O)NC3=CC=C(C=C3)C(=O)N)C4=CN=CN=C4

InChI

InChI=1S/C22H18N6O2/c23-22(30)15-4-6-19(7-5-15)26-21(29)13-28-9-8-20(27-28)17-3-1-2-16(10-17)18-11-24-14-25-12-18/h1-12,14H,13H2,(H2,23,30)(H,26,29)