N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-fluoro-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(3,5-dimethyl-1-pyrazolyl)phenyl]-4-fluoro-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-fluoro-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-fluoro-3-piperidinosulfonyl-benzamide Formula: C23H25FN4O3S MolecularWeight: 456.533003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C23H25FN4O3S/c1-16-14-17(2)28(26-16)21-9-5-4-8-20(21)25-23(29)18-10-11-19(24)22(15-18)32(30,31)27-12-6-3-7-13-27/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3,(H,25,29)