N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]quinoxaline-2-carboxamide

Systemtic Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]quinoxaline-2-carboxamide Openeye Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]quinoxaline-2-carboxamide CAS Name: N-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]phenyl]-2-quinoxalinecarboxamide IUPAC Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]quinoxaline-2-carboxamide Traditional Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]quinoxaline-2-carboxamide Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)N4C=CC=N4

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)N4C=CC=N4

InChI

InChI=1S/C21H18N6O2/c1-14(27-11-5-10-23-27)20(28)24-15-6-4-7-16(12-15)25-21(29)19-13-22-17-8-2-3-9-18(17)26-19/h2-14H,1H3,(H,24,28)(H,25,29)