(2R)-2-phenyl-2-phenylsulfanyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]ethanamide

Systemtic Name: (2R)-2-phenyl-2-phenylsulfanyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]ethanamide Openeye Name: (2R)-2-phenyl-2-phenylsulfanyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]acetamide CAS Name: (2R)-2-phenyl-2-(phenylthio)-N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: (2R)-2-phenyl-2-phenylsulfanyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]acetamide Traditional Name: (2R)-2-phenyl-2-(phenylthio)-N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]acetamide Formula: C24H26N3OS+ MolecularWeight: 404.54774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)[C@@H](C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H25N3OS/c28-24(26-18-19-13-14-22(25-17-19)27-15-7-8-16-27)23(20-9-3-1-4-10-20)29-21-11-5-2-6-12-21/h1-6,9-14,17,23H,7-8,15-16,18H2,(H,26,28)/p+1/t23-/m1/s1