N-[3,4-bis(fluoranyl)phenyl]-2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)ethanamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)ethanamide Openeye Name: N-(3,4-difluorophenyl)-2-[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]acetamide CAS Name: N-(3,4-difluorophenyl)-2-[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]acetamide IUPAC Name: N-(3,4-difluorophenyl)-2-(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)acetamide Traditional Name: N-(3,4-difluorophenyl)-2-(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)acetamide Formula: C18H22F2N4O3S MolecularWeight: 412.454086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC(=C(C=C2)F)F)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC(=C(C=C2)F)F)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22F2N4O3S/c1-12-18(28(26,27)23-8-4-3-5-9-23)13(2)24(22-12)11-17(25)21-14-6-7-15(19)16(20)10-14/h6-7,10H,3-5,8-9,11H2,1-2H3,(H,21,25)