N-[[1-[3-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[1-[3-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[1-[3-(3-hydroxy-3-methyl-but-1-ynyl)benzoyl]-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[1-[[3-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-oxomethyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[1-[3-(3-hydroxy-3-methylbut-1-ynyl)benzoyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[1-[3-(3-hydroxy-3-methyl-but-1-ynyl)benzoyl]-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC(=CC=C1)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3)O

Isomeric SMILES

CC(C)(C#CC1=CC(=CC=C1)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3)O

InChI

InChI=1S/C22H26N2O4S2/c1-22(2,26)11-10-17-6-3-8-19(14-17)21(25)24-12-4-7-18(16-24)15-23-30(27,28)20-9-5-13-29-20/h3,5-6,8-9,13-14,18,23,26H,4,7,12,15-16H2,1-2H3