N-[[(3S)-1-[[7-tert-butyl-5-(2-oxidanylidene-1H-pyridin-3-yl)-1-benzofuran-3-yl]carbonyl]piperidin-3-yl]methyl]methanesulfonamide

Systemtic Name: N-[[(3S)-1-[[7-tert-butyl-5-(2-oxidanylidene-1H-pyridin-3-yl)-1-benzofuran-3-yl]carbonyl]piperidin-3-yl]methyl]methanesulfonamide Openeye Name: N-[[(3S)-1-[7-tert-butyl-5-(2-oxo-1H-pyridin-3-yl)benzofuran-3-carbonyl]-3-piperidyl]methyl]methanesulfonamide CAS Name: N-[[(3S)-1-[[7-tert-butyl-5-(2-oxo-1H-pyridin-3-yl)-3-benzofuranyl]-oxomethyl]-3-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[(3S)-1-[7-tert-butyl-5-(2-oxo-1H-pyridin-3-yl)-1-benzofuran-3-carbonyl]piperidin-3-yl]methyl]methanesulfonamide Traditional Name: N-[[(3S)-1-[7-tert-butyl-5-(2-keto-1H-pyridin-3-yl)benzofuran-3-carbonyl]-3-piperidyl]methyl]methanesulfonamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=CC(=C1)C3=CC=CNC3=O)C(=CO2)C(=O)N4CCCC(C4)CNS(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=C2C(=CC(=C1)C3=CC=CNC3=O)C(=CO2)C(=O)N4CCC[C@@H](C4)CNS(=O)(=O)C

InChI

InChI=1S/C25H31N3O5S/c1-25(2,3)21-12-17(18-8-5-9-26-23(18)29)11-19-20(15-33-22(19)21)24(30)28-10-6-7-16(14-28)13-27-34(4,31)32/h5,8-9,11-12,15-16,27H,6-7,10,13-14H2,1-4H3,(H,26,29)/t16-/m1/s1