4-fluoranyl-N-[3-methyl-1-oxidanylidene-1-[2-(1-phenylpyrazol-4-yl)ethylamino]butan-2-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[3-methyl-1-oxidanylidene-1-[2-(1-phenylpyrazol-4-yl)ethylamino]butan-2-yl]benzamide Openeye Name: 4-fluoro-N-[2-methyl-1-[2-(1-phenylpyrazol-4-yl)ethylcarbamoyl]propyl]benzamide CAS Name: 4-fluoro-N-[3-methyl-1-oxo-1-[2-(1-phenyl-4-pyrazolyl)ethylamino]butan-2-yl]benzamide IUPAC Name: 4-fluoro-N-[3-methyl-1-oxo-1-[2-(1-phenylpyrazol-4-yl)ethylamino]butan-2-yl]benzamide Traditional Name: 4-fluoro-N-[2-methyl-1-[2-(1-phenylpyrazol-4-yl)ethylcarbamoyl]propyl]benzamide Formula: C23H25FN4O2 MolecularWeight: 408.468603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=CN(N=C1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C(C(=O)NCCC1=CN(N=C1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H25FN4O2/c1-16(2)21(27-22(29)18-8-10-19(24)11-9-18)23(30)25-13-12-17-14-26-28(15-17)20-6-4-3-5-7-20/h3-11,14-16,21H,12-13H2,1-2H3,(H,25,30)(H,27,29)