N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(3-fluorophenyl)methyl-methyl-amino]propanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(3-fluorophenyl)methyl-methyl-amino]propanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[(3-fluorophenyl)methyl-methyl-amino]propanamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[(3-fluorophenyl)methyl-methylamino]propanamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[(3-fluorophenyl)methyl-methylamino]propanamide Traditional Name: 3-[(3-fluorobenzyl)-methyl-amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)propionamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCN(C)CC3=CC(=CC=C3)F

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCN(C)CC3=CC(=CC=C3)F

InChI

InChI=1S/C22H25FN4O2/c1-16-21(22(29)27(26(16)3)19-10-5-4-6-11-19)24-20(28)12-13-25(2)15-17-8-7-9-18(23)14-17/h4-11,14H,12-13,15H2,1-3H3,(H,24,28)