N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[3-[[3-(1-imidazolyl)-1-oxopropyl]amino]phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-1-phenyl-pyrazole-4-carboxamide Formula: C22H20N6O2 MolecularWeight: 400.4332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NC3=CC(=CC=C3)NC(=O)CCN4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NC3=CC(=CC=C3)NC(=O)CCN4C=CN=C4

InChI

InChI=1S/C22H20N6O2/c29-21(9-11-27-12-10-23-16-27)25-18-5-4-6-19(13-18)26-22(30)17-14-24-28(15-17)20-7-2-1-3-8-20/h1-8,10,12-16H,9,11H2,(H,25,29)(H,26,30)