ethyl 1-(2-methoxyethyl)-2-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-(2-methoxyethyl)-2-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-(2-methoxyethyl)-2-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-(2-methoxyethyl)-2-[[2-oxo-2-(2-oxolanylmethylamino)ethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methoxyethyl)-2-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 2-[[2-keto-2-(tetrahydrofurfurylamino)ethyl]thio]-1-(2-methoxyethyl)benzimidazole-5-carboxylic acid ethyl ester Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)NCC3CCCO3)CCOC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)NCC3CCCO3)CCOC

InChI

InChI=1S/C20H27N3O5S/c1-3-27-19(25)14-6-7-17-16(11-14)22-20(23(17)8-10-26-2)29-13-18(24)21-12-15-5-4-9-28-15/h6-7,11,15H,3-5,8-10,12-13H2,1-2H3,(H,21,24)