ethyl 4-(1H-benzimidazol-2-yl)-2-sulfanyl-butanoate

Systemtic Name: ethyl 4-(1H-benzimidazol-2-yl)-2-sulfanyl-butanoate Openeye Name: ethyl 4-(1H-benzimidazol-2-yl)-2-sulfanyl-butanoate CAS Name: 4-(1H-benzimidazol-2-yl)-2-mercaptobutanoic acid ethyl ester IUPAC Name: ethyl 4-(1H-benzimidazol-2-yl)-2-sulfanylbutanoate Traditional Name: 4-(1H-benzimidazol-2-yl)-2-mercapto-butyric acid ethyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=NC2=CC=CC=C2N1)S

Isomeric SMILES

CCOC(=O)C(CCC1=NC2=CC=CC=C2N1)S

InChI

InChI=1S/C13H16N2O2S/c1-2-17-13(16)11(18)7-8-12-14-9-5-3-4-6-10(9)15-12/h3-6,11,18H,2,7-8H2,1H3,(H,14,15)