N-methyl-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-[(4-methylsulfanylphenyl)methyl]ethanamide

Systemtic Name: N-methyl-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-[(4-methylsulfanylphenyl)methyl]ethanamide Openeye Name: N-methyl-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-[(4-methylsulfanylphenyl)methyl]acetamide CAS Name: N-methyl-2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]-N-[[4-(methylthio)phenyl]methyl]acetamide IUPAC Name: N-methyl-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-[(4-methylsulfanylphenyl)methyl]acetamide Traditional Name: N-methyl-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-[4-(methylthio)benzyl]acetamide Formula: C20H28N3OS+ MolecularWeight: 358.52082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCC[NH+]2CC(=O)N(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CN1C=CC=C1[C@H]2CCC[NH+]2CC(=O)N(C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H27N3OS/c1-21-12-4-6-18(21)19-7-5-13-23(19)15-20(24)22(2)14-16-8-10-17(25-3)11-9-16/h4,6,8-12,19H,5,7,13-15H2,1-3H3/p+1/t19-/m1/s1