N,2-dicyclohexyl-2-[6-fluoranyl-2-(phenylsulfinylmethyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N,2-dicyclohexyl-2-[6-fluoranyl-2-(phenylsulfinylmethyl)benzimidazol-1-yl]ethanamide Openeye Name: 2-[2-(benzenesulfinylmethyl)-6-fluoro-benzimidazol-1-yl]-N,2-dicyclohexyl-acetamide CAS Name: 2-[2-(benzenesulfinylmethyl)-6-fluoro-1-benzimidazolyl]-N,2-dicyclohexylacetamide IUPAC Name: 2-[2-(benzenesulfinylmethyl)-6-fluorobenzimidazol-1-yl]-N,2-dicyclohexylacetamide Traditional Name: 2-[2-(benzenesulfinylmethyl)-6-fluoro-benzimidazol-1-yl]-N,2-dicyclohexyl-acetamide Formula: C28H34FN3O2S MolecularWeight: 495.651863

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)NC2CCCCC2)N3C4=C(C=CC(=C4)F)N=C3CS(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C(C(=O)NC2CCCCC2)N3C4=C(C=CC(=C4)F)N=C3CS(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H34FN3O2S/c29-21-16-17-24-25(18-21)32(26(31-24)19-35(34)23-14-8-3-9-15-23)27(20-10-4-1-5-11-20)28(33)30-22-12-6-2-7-13-22/h3,8-9,14-18,20,22,27H,1-2,4-7,10-13,19H2,(H,30,33)