(2R)-2-(2,5-dimethylpyrrol-1-yl)-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-(2,5-dimethylpyrrol-1-yl)-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-(2,5-dimethylpyrrol-1-yl)-4-methylsulfanyl-butanoate CAS Name: (2R)-2-(2,5-dimethyl-1-pyrrolyl)-4-(methylthio)butanoate IUPAC Name: (2R)-2-(2,5-dimethylpyrrol-1-yl)-4-methylsulfanylbutanoate Traditional Name: (2R)-2-(2,5-dimethylpyrrol-1-yl)-4-(methylthio)butyrate Formula: C11H16NO2S- MolecularWeight: 226.31524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C(CCSC)C(=O)[O-])C

Isomeric SMILES

CC1=CC=C(N1[C@H](CCSC)C(=O)[O-])C

InChI

InChI=1S/C11H17NO2S/c1-8-4-5-9(2)12(8)10(11(13)14)6-7-15-3/h4-5,10H,6-7H2,1-3H3,(H,13,14)/p-1/t10-/m1/s1