3-bromanyl-4-ethoxy-5-methoxy-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-5-methoxy-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-ethoxy-5-methoxy-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-ethoxy-5-methoxy-N-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]phenyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-5-methoxy-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Traditional Name: 3-bromo-4-ethoxy-5-methoxy-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Formula: C22H23BrN4O4 MolecularWeight: 487.34642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)N3C=CC=N3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)N3C=CC=N3)OC

InChI

InChI=1S/C22H23BrN4O4/c1-4-31-20-18(23)11-15(12-19(20)30-3)22(29)26-17-8-5-7-16(13-17)25-21(28)14(2)27-10-6-9-24-27/h5-14H,4H2,1-3H3,(H,25,28)(H,26,29)