ethyl 2-[2-(2-ethoxyethylamino)-2-oxidanylidene-ethyl]sulfanyl-1-(furan-2-ylmethyl)benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[2-(2-ethoxyethylamino)-2-oxidanylidene-ethyl]sulfanyl-1-(furan-2-ylmethyl)benzimidazole-5-carboxylate Openeye Name: ethyl 2-[2-(2-ethoxyethylamino)-2-oxo-ethyl]sulfanyl-1-(2-furylmethyl)benzimidazole-5-carboxylate CAS Name: 2-[[2-(2-ethoxyethylamino)-2-oxoethyl]thio]-1-(2-furanylmethyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-ethoxyethylamino)-2-oxoethyl]sulfanyl-1-(furan-2-ylmethyl)benzimidazole-5-carboxylate Traditional Name: 2-[[2-(2-ethoxyethylamino)-2-keto-ethyl]thio]-1-(2-furfuryl)benzimidazole-5-carboxylic acid ethyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCNC(=O)CSC1=NC2=C(N1CC3=CC=CO3)C=CC(=C2)C(=O)OCC

Isomeric SMILES

CCOCCNC(=O)CSC1=NC2=C(N1CC3=CC=CO3)C=CC(=C2)C(=O)OCC

InChI

InChI=1S/C21H25N3O5S/c1-3-27-11-9-22-19(25)14-30-21-23-17-12-15(20(26)28-4-2)7-8-18(17)24(21)13-16-6-5-10-29-16/h5-8,10,12H,3-4,9,11,13-14H2,1-2H3,(H,22,25)