N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1-[(4-methyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1-(4-methylpiperidino)sulfonyl-nipecotamide Formula: C21H28FN5O3S MolecularWeight: 449.542123

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NNC(=C3)C4=CC(=CC=C4)F

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NNC(=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H28FN5O3S/c1-15-7-10-26(11-8-15)31(29,30)27-9-3-5-17(14-27)21(28)23-20-13-19(24-25-20)16-4-2-6-18(22)12-16/h2,4,6,12-13,15,17H,3,5,7-11,14H2,1H3,(H2,23,24,25,28)