dimethyl 2-(1H-benzimidazol-2-ylsulfanylmethyl)butanedioate

Systemtic Name: dimethyl 2-(1H-benzimidazol-2-ylsulfanylmethyl)butanedioate Openeye Name: dimethyl 2-(1H-benzimidazol-2-ylsulfanylmethyl)butanedioate CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]butanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(1H-benzimidazol-2-ylsulfanylmethyl)butanedioate Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]succinic acid dimethyl ester Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CSC1=NC2=CC=CC=C2N1)C(=O)OC

Isomeric SMILES

COC(=O)CC(CSC1=NC2=CC=CC=C2N1)C(=O)OC

InChI

InChI=1S/C14H16N2O4S/c1-19-12(17)7-9(13(18)20-2)8-21-14-15-10-5-3-4-6-11(10)16-14/h3-6,9H,7-8H2,1-2H3,(H,15,16)