N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-fluoranyl-4-(4-methylpiperazin-1-yl)benzamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-fluoranyl-4-(4-methylpiperazin-1-yl)benzamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-fluoro-4-(4-methylpiperazin-1-yl)benzamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-fluoro-4-(4-methyl-1-piperazinyl)benzamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-fluoro-4-(4-methylpiperazin-1-yl)benzamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-fluoro-4-(4-methylpiperazino)benzamide Formula: C24H28FN5O MolecularWeight: 421.510423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC(=C(C=C3)N4CCN(CC4)C)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC(=C(C=C3)N4CCN(CC4)C)F

InChI

InChI=1S/C24H28FN5O/c1-17-21(18(2)30(27-17)20-7-5-4-6-8-20)16-26-24(31)19-9-10-23(22(25)15-19)29-13-11-28(3)12-14-29/h4-10,15H,11-14,16H2,1-3H3,(H,26,31)