ethyl 2-[(4-chlorophenyl)methylsulfanyl]-1-ethyl-benzimidazole-5-carboxylate hydrochloride

Systemtic Name: ethyl 2-[(4-chlorophenyl)methylsulfanyl]-1-ethyl-benzimidazole-5-carboxylate hydrochloride Openeye Name: ethyl 2-[(4-chlorophenyl)methylsulfanyl]-1-ethyl-benzimidazole-5-carboxylate hydrochloride CAS Name: 2-[(4-chlorophenyl)methylthio]-1-ethyl-5-benzimidazolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 2-[(4-chlorophenyl)methylsulfanyl]-1-ethylbenzimidazole-5-carboxylate hydrochloride Traditional Name: 2-[(4-chlorobenzyl)thio]-1-ethyl-benzimidazole-5-carboxylic acid ethyl ester hydrochloride Formula: C19H20Cl2N2O2S MolecularWeight: 411.3453

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC3=CC=C(C=C3)Cl.Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC3=CC=C(C=C3)Cl.Cl

InChI

InChI=1S/C19H19ClN2O2S.ClH/c1-3-22-17-10-7-14(18(23)24-4-2)11-16(17)21-19(22)25-12-13-5-8-15(20)9-6-13;/h5-11H,3-4,12H2,1-2H3;1H