1-[(2-phenylsulfanylphenyl)methyl]pyrrolidin-1-ium

Systemtic Name: 1-[(2-phenylsulfanylphenyl)methyl]pyrrolidin-1-ium Openeye Name: 1-[(2-phenylsulfanylphenyl)methyl]pyrrolidin-1-ium CAS Name: 1-[[2-(phenylthio)phenyl]methyl]pyrrolidin-1-ium IUPAC Name: 1-[(2-phenylsulfanylphenyl)methyl]pyrrolidin-1-ium Traditional Name: 1-[2-(phenylthio)benzyl]pyrrolidin-1-ium Formula: C17H20NS+ MolecularWeight: 270.4124

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2SC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2SC3=CC=CC=C3

InChI

InChI=1S/C17H19NS/c1-2-9-16(10-3-1)19-17-11-5-4-8-15(17)14-18-12-6-7-13-18/h1-5,8-11H,6-7,12-14H2/p+1