(2R)-2-(1-ethoxycarbonylbenzimidazol-2-yl)sulfanylbutanoic acid

Systemtic Name: (2R)-2-(1-ethoxycarbonylbenzimidazol-2-yl)sulfanylbutanoic acid Openeye Name: (2R)-2-(1-ethoxycarbonylbenzimidazol-2-yl)sulfanylbutanoic acid CAS Name: (2R)-2-[(1-ethoxycarbonyl-2-benzimidazolyl)thio]butanoic acid IUPAC Name: (2R)-2-(1-ethoxycarbonylbenzimidazol-2-yl)sulfanylbutanoic acid Traditional Name: (2R)-2-[(1-carbethoxybenzimidazol-2-yl)thio]butyric acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC1=NC2=CC=CC=C2N1C(=O)OCC

Isomeric SMILES

CC[C@H](C(=O)O)SC1=NC2=CC=CC=C2N1C(=O)OCC

InChI

InChI=1S/C14H16N2O4S/c1-3-11(12(17)18)21-13-15-9-7-5-6-8-10(9)16(13)14(19)20-4-2/h5-8,11H,3-4H2,1-2H3,(H,17,18)/t11-/m1/s1