(3S,5R)-5-[4-(methylaminomethyl)phenyl]pyrrolidine-3-thiol

Systemtic Name: (3S,5R)-5-[4-(methylaminomethyl)phenyl]pyrrolidine-3-thiol Openeye Name: (3S,5R)-5-[4-(methylaminomethyl)phenyl]pyrrolidine-3-thiol CAS Name: (3S,5R)-5-[4-(methylaminomethyl)phenyl]-3-pyrrolidinethiol IUPAC Name: (3S,5R)-5-[4-(methylaminomethyl)phenyl]pyrrolidine-3-thiol Traditional Name: (3S,5R)-5-[4-(methylaminomethyl)phenyl]pyrrolidine-3-thiol Formula: C12H18N2S MolecularWeight: 222.34972

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=C(C=C1)C2CC(CN2)S

Isomeric SMILES

CNCC1=CC=C(C=C1)[C@H]2C[C@@H](CN2)S

InChI

InChI=1S/C12H18N2S/c1-13-7-9-2-4-10(5-3-9)12-6-11(15)8-14-12/h2-5,11-15H,6-8H2,1H3/t11-,12+/m0/s1