tert-butyl 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoate Openeye Name: tert-butyl 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetate CAS Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]acetic acid tert-butyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)OC(C)(C)C

InChI

InChI=1S/C15H20N2O3S/c1-5-19-10-6-7-11-12(8-10)17-14(16-11)21-9-13(18)20-15(2,3)4/h6-8H,5,9H2,1-4H3,(H,16,17)