ethyl 1-ethyl-2-phenacylsulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-phenacylsulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-phenacylsulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-(phenacylthio)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-phenacylsulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-(phenacylthio)benzimidazole-5-carboxylic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-3-22-17-11-10-15(19(24)25-4-2)12-16(17)21-20(22)26-13-18(23)14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3