ethyl 2-[(1R)-2-ethoxy-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-1-ethyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[(1R)-2-ethoxy-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-1-ethyl-benzimidazole-5-carboxylate Openeye Name: ethyl 2-[(1R)-2-ethoxy-2-oxo-1-phenyl-ethyl]sulfanyl-1-ethyl-benzimidazole-5-carboxylate CAS Name: 2-[[(1R)-2-ethoxy-2-oxo-1-phenylethyl]thio]-1-ethyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1R)-2-ethoxy-2-oxo-1-phenylethyl]sulfanyl-1-ethylbenzimidazole-5-carboxylate Traditional Name: 2-[[(1R)-2-ethoxy-2-keto-1-phenyl-ethyl]thio]-1-ethyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SC(C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1S[C@H](C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C22H24N2O4S/c1-4-24-18-13-12-16(20(25)27-5-2)14-17(18)23-22(24)29-19(21(26)28-6-3)15-10-8-7-9-11-15/h7-14,19H,4-6H2,1-3H3/t19-/m1/s1