(2S)-2-(2-methylphenyl)-2-pyrrolidin-1-yl-ethanethioamide

Systemtic Name: (2S)-2-(2-methylphenyl)-2-pyrrolidin-1-yl-ethanethioamide Openeye Name: (2S)-2-(o-tolyl)-2-pyrrolidin-1-yl-thioacetamide CAS Name: (2S)-2-(2-methylphenyl)-2-(1-pyrrolidinyl)ethanethioamide IUPAC Name: (2S)-2-(2-methylphenyl)-2-pyrrolidin-1-ylethanethioamide Traditional Name: (2S)-2-(o-tolyl)-2-pyrrolidino-thioacetamide Formula: C13H18N2S MolecularWeight: 234.36042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C(=S)N)N2CCCC2

Isomeric SMILES

CC1=CC=CC=C1[C@@H](C(=S)N)N2CCCC2

InChI

InChI=1S/C13H18N2S/c1-10-6-2-3-7-11(10)12(13(14)16)15-8-4-5-9-15/h2-3,6-7,12H,4-5,8-9H2,1H3,(H2,14,16)/t12-/m0/s1