N-[[(3S)-1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]carbonyl]piperidin-3-yl]methyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[[(3S)-1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]carbonyl]piperidin-3-yl]methyl]-1-phenyl-methanesulfonamide Openeye Name: N-[[(3S)-1-(5-isobutyl-1H-pyrazole-3-carbonyl)-3-piperidyl]methyl]-1-phenyl-methanesulfonamide CAS Name: N-[[(3S)-1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]-oxomethyl]-3-piperidinyl]methyl]-1-phenylmethanesulfonamide IUPAC Name: N-[[(3S)-1-[5-(2-methylpropyl)-1H-pyrazole-3-carbonyl]piperidin-3-yl]methyl]-1-phenylmethanesulfonamide Traditional Name: N-[[(3S)-1-(5-isobutyl-1H-pyrazole-3-carbonyl)-3-piperidyl]methyl]-1-phenyl-methanesulfonamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1)C(=O)N2CCCC(C2)CNS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=CC(=NN1)C(=O)N2CCC[C@@H](C2)CNS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H30N4O3S/c1-16(2)11-19-12-20(24-23-19)21(26)25-10-6-9-18(14-25)13-22-29(27,28)15-17-7-4-3-5-8-17/h3-5,7-8,12,16,18,22H,6,9-11,13-15H2,1-2H3,(H,23,24)/t18-/m1/s1