(2R)-N-(2-phenylsulfanylphenyl)-2-pyrrolidin-1-ium-1-yl-propanamide

Systemtic Name: (2R)-N-(2-phenylsulfanylphenyl)-2-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: (2R)-N-(2-phenylsulfanylphenyl)-2-pyrrolidin-1-ium-1-yl-propanamide CAS Name: (2R)-N-[2-(phenylthio)phenyl]-2-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: (2R)-N-(2-phenylsulfanylphenyl)-2-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: (2R)-N-[2-(phenylthio)phenyl]-2-pyrrolidin-1-ium-1-yl-propionamide Formula: C19H23N2OS+ MolecularWeight: 327.46372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C19H22N2OS/c1-15(21-13-7-8-14-21)19(22)20-17-11-5-6-12-18(17)23-16-9-3-2-4-10-16/h2-6,9-12,15H,7-8,13-14H2,1H3,(H,20,22)/p+1/t15-/m1/s1