N-[3-(dimethylamino)propyl]-4-[5-(3-fluorophenyl)-3-oxidanylidene-1H-pyrazol-2-yl]benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-4-[5-(3-fluorophenyl)-3-oxidanylidene-1H-pyrazol-2-yl]benzamide Openeye Name: N-[3-(dimethylamino)propyl]-4-[5-(3-fluorophenyl)-3-oxo-1H-pyrazol-2-yl]benzamide CAS Name: N-[3-(dimethylamino)propyl]-4-[5-(3-fluorophenyl)-3-oxo-1H-pyrazol-2-yl]benzamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-[5-(3-fluorophenyl)-3-oxo-1H-pyrazol-2-yl]benzamide Traditional Name: N-[3-(dimethylamino)propyl]-4-[3-(3-fluorophenyl)-5-keto-3-pyrazolin-1-yl]benzamide Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=CC=C(C=C1)N2C(=O)C=C(N2)C3=CC(=CC=C3)F

Isomeric SMILES

CN(C)CCCNC(=O)C1=CC=C(C=C1)N2C(=O)C=C(N2)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H23FN4O2/c1-25(2)12-4-11-23-21(28)15-7-9-18(10-8-15)26-20(27)14-19(24-26)16-5-3-6-17(22)13-16/h3,5-10,13-14,24H,4,11-12H2,1-2H3,(H,23,28)