ethyl 1-ethyl-2-[2-oxidanylidene-2-(propylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-oxidanylidene-2-(propylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-oxo-2-(propylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-oxo-2-(propylamino)ethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-oxo-2-(propylamino)ethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-keto-2-(propylamino)ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)C(=O)OCC

Isomeric SMILES

CCCNC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)C(=O)OCC

InChI

InChI=1S/C17H23N3O3S/c1-4-9-18-15(21)11-24-17-19-13-10-12(16(22)23-6-3)7-8-14(13)20(17)5-2/h7-8,10H,4-6,9,11H2,1-3H3,(H,18,21)