(3S)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiomorpholin-4-ium

Systemtic Name: (3S)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiomorpholin-4-ium Openeye Name: (3S)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiomorpholin-4-ium CAS Name: (3S)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]thiomorpholin-4-ium IUPAC Name: (3S)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiomorpholin-4-ium Traditional Name: (3S)-3-(4-pyrrolidinosulfonylphenyl)thiomorpholin-4-ium Formula: C14H21N2O2S2+ MolecularWeight: 313.45874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3CSCC[NH2+]3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)[C@H]3CSCC[NH2+]3

InChI

InChI=1S/C14H20N2O2S2/c17-20(18,16-8-1-2-9-16)13-5-3-12(4-6-13)14-11-19-10-7-15-14/h3-6,14-15H,1-2,7-11H2/p+1/t14-/m1/s1