(3R)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(4-methylsulfanylphenyl)-5-oxo-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxamide CAS Name: (3R)-1-[4-(methylthio)phenyl]-5-oxo-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(4-methylsulfanylphenyl)-5-oxo-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]pyrrolidine-3-carboxamide Traditional Name: (3R)-5-keto-1-[4-(methylthio)phenyl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrrolidine-3-carboxamide Formula: C24H30N3O2S+ MolecularWeight: 424.5789

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCC(C3=CC=CC=C3)[NH+]4CCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)NC[C@@H](C3=CC=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C24H29N3O2S/c1-30-21-11-9-20(10-12-21)27-17-19(15-23(27)28)24(29)25-16-22(26-13-5-6-14-26)18-7-3-2-4-8-18/h2-4,7-12,19,22H,5-6,13-17H2,1H3,(H,25,29)/p+1/t19-,22+/m1/s1