ethyl 4-[5-fluoranyl-2-(sulfanylmethyl)benzimidazol-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[5-fluoranyl-2-(sulfanylmethyl)benzimidazol-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[5-fluoro-2-(sulfanylmethyl)benzimidazol-1-yl]piperidine-1-carboxylate CAS Name: 4-[5-fluoro-2-(mercaptomethyl)-1-benzimidazolyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-fluoro-2-(sulfanylmethyl)benzimidazol-1-yl]piperidine-1-carboxylate Traditional Name: 4-[5-fluoro-2-(mercaptomethyl)benzimidazol-1-yl]piperidine-1-carboxylic acid ethyl ester Formula: C16H20FN3O2S MolecularWeight: 337.412303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C3=C(C=C(C=C3)F)N=C2CS

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C3=C(C=C(C=C3)F)N=C2CS

InChI

InChI=1S/C16H20FN3O2S/c1-2-22-16(21)19-7-5-12(6-8-19)20-14-4-3-11(17)9-13(14)18-15(20)10-23/h3-4,9,12,23H,2,5-8,10H2,1H3