2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide

Systemtic Name: 2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-methyl-5-(p-tolylsulfamoyl)benzamide CAS Name: 2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-methyl-5-[(4-methylphenyl)sulfamoyl]benzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-methyl-5-(p-tolylsulfamoyl)benzamide Formula: C26H30N3O3S+ MolecularWeight: 464.5997

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S/c1-19-8-11-22(12-9-19)28-33(31,32)24-13-10-20(2)25(16-24)26(30)27-23-14-15-29(18-23)17-21-6-4-3-5-7-21/h3-13,16,23,28H,14-15,17-18H2,1-2H3,(H,27,30)/p+1/t23-/m0/s1