phenyl 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylbenzimidazole-1-carboxylate

Systemtic Name: phenyl 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylbenzimidazole-1-carboxylate Openeye Name: phenyl 2-[2-(diethylamino)-2-oxo-ethyl]sulfanylbenzimidazole-1-carboxylate CAS Name: 2-[[2-(diethylamino)-2-oxoethyl]thio]-1-benzimidazolecarboxylic acid phenyl ester IUPAC Name: phenyl 2-[2-(diethylamino)-2-oxoethyl]sulfanylbenzimidazole-1-carboxylate Traditional Name: 2-[[2-(diethylamino)-2-keto-ethyl]thio]benzimidazole-1-carboxylic acid phenyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC2=CC=CC=C2N1C(=O)OC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC2=CC=CC=C2N1C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3S/c1-3-22(4-2)18(24)14-27-19-21-16-12-8-9-13-17(16)23(19)20(25)26-15-10-6-5-7-11-15/h5-13H,3-4,14H2,1-2H3