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

Systemtic Name: methyl 2-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: methyl 2-[1-(2-morpholino-2-oxo-ethyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[2-(4-morpholinyl)-2-oxoethyl]-2-benzimidazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 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]acetic acid methyl ester Formula: C16H19N3O4S MolecularWeight: 349.40476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC2=CC=CC=C2N1CC(=O)N3CCOCC3

Isomeric SMILES

COC(=O)CSC1=NC2=CC=CC=C2N1CC(=O)N3CCOCC3

InChI

InChI=1S/C16H19N3O4S/c1-22-15(21)11-24-16-17-12-4-2-3-5-13(12)19(16)10-14(20)18-6-8-23-9-7-18/h2-5H,6-11H2,1H3