(3S)-N-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]thiolan-3-amine

Systemtic Name: (3S)-N-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]thiolan-3-amine Openeye Name: (3S)-N-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]tetrahydrothiophen-3-amine CAS Name: (3S)-N-[(2R)-3-methyl-2-(1-pyrrolidin-1-iumyl)butyl]-3-thiolanamine IUPAC Name: (3S)-N-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-ylbutyl]thiolan-3-amine Traditional Name: [(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]-[(3S)-tetrahydrothiophen-3-yl]amine Formula: C13H27N2S+ MolecularWeight: 243.43188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC1CCSC1)[NH+]2CCCC2

Isomeric SMILES

CC(C)[C@H](CN[C@H]1CCSC1)[NH+]2CCCC2

InChI

InChI=1S/C13H26N2S/c1-11(2)13(15-6-3-4-7-15)9-14-12-5-8-16-10-12/h11-14H,3-10H2,1-2H3/p+1/t12-,13-/m0/s1