(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethanethioamide

Systemtic Name: (2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethanethioamide Openeye Name: (2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-thioacetamide CAS Name: (2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethanethioamide IUPAC Name: (2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethanethioamide Traditional Name: (2S)-2-(4-methoxyphenyl)-2-pyrrolidino-thioacetamide Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(=S)N)N2CCCC2

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](C(=S)N)N2CCCC2

InChI

InChI=1S/C13H18N2OS/c1-16-11-6-4-10(5-7-11)12(13(14)17)15-8-2-3-9-15/h4-7,12H,2-3,8-9H2,1H3,(H2,14,17)/t12-/m0/s1