N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]phenyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C21H19N7O2 MolecularWeight: 401.42126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)N3C=NC=N3)N4C=CC=N4

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)N3C=NC=N3)N4C=CC=N4

InChI

InChI=1S/C21H19N7O2/c1-15(27-11-3-10-23-27)20(29)25-17-4-2-5-18(12-17)26-21(30)16-6-8-19(9-7-16)28-14-22-13-24-28/h2-15H,1H3,(H,25,29)(H,26,30)