2-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-(2-morpholino-2-oxo-ethyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[2-(4-morpholinyl)-2-oxoethyl]-2-benzimidazolyl]thio]acetate IUPAC Name: 2-[1-(2-morpholin-4-yl-2-oxoethyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(2-keto-2-morpholino-ethyl)benzimidazol-2-yl]thio]acetate Formula: C15H16N3O4S- MolecularWeight: 334.37024

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)[O-]

InChI

InChI=1S/C15H17N3O4S/c19-13(17-5-7-22-8-6-17)9-18-12-4-2-1-3-11(12)16-15(18)23-10-14(20)21/h1-4H,5-10H2,(H,20,21)/p-1