2-but-1-ynyl-4-[4-(phenylmethyl)piperidin-1-yl]benzenesulfonamide

Systemtic Name: 2-but-1-ynyl-4-[4-(phenylmethyl)piperidin-1-yl]benzenesulfonamide Openeye Name: 4-(4-benzyl-1-piperidyl)-2-but-1-ynyl-benzenesulfonamide CAS Name: 2-but-1-ynyl-4-[4-(phenylmethyl)-1-piperidinyl]benzenesulfonamide IUPAC Name: 4-(4-benzylpiperidin-1-yl)-2-but-1-ynylbenzenesulfonamide Traditional Name: 4-(4-benzylpiperidino)-2-but-1-ynyl-benzenesulfonamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1=C(C=CC(=C1)N2CCC(CC2)CC3=CC=CC=C3)S(=O)(=O)N

Isomeric SMILES

CCC#CC1=C(C=CC(=C1)N2CCC(CC2)CC3=CC=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C22H26N2O2S/c1-2-3-9-20-17-21(10-11-22(20)27(23,25)26)24-14-12-19(13-15-24)16-18-7-5-4-6-8-18/h4-8,10-11,17,19H,2,12-16H2,1H3,(H2,23,25,26)