ethyl 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-1-ethyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-1-ethyl-benzimidazole-5-carboxylate Openeye Name: ethyl 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-1-ethyl-benzimidazole-5-carboxylate CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-1-ethyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-1-ethylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[(2-keto-3,3-dimethyl-butyl)thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O3S/c1-6-20-14-9-8-12(16(22)23-7-2)10-13(14)19-17(20)24-11-15(21)18(3,4)5/h8-10H,6-7,11H2,1-5H3