5-(dimethylsulfamoyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-2-piperidin-1-yl-benzamide

Systemtic Name: 5-(dimethylsulfamoyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-2-piperidin-1-yl-benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-5-(dimethylsulfamoyl)-2-(1-piperidyl)benzamide CAS Name: 5-(dimethylsulfamoyl)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-2-(1-piperidinyl)benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-5-(dimethylsulfamoyl)-2-piperidin-1-ylbenzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-5-(dimethylsulfamoyl)-2-piperidino-benzamide Formula: C25H35N4O3S+ MolecularWeight: 471.6354

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H34N4O3S/c1-27(2)33(31,32)22-11-12-24(29-14-7-4-8-15-29)23(17-22)25(30)26-21-13-16-28(19-21)18-20-9-5-3-6-10-20/h3,5-6,9-12,17,21H,4,7-8,13-16,18-19H2,1-2H3,(H,26,30)/p+1/t21-/m0/s1