3-[3-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[[4-cyclohexyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCCCN3C4=CC=CC=C4NC3=O)C5=CC=CO5

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCCCN3C4=CC=CC=C4NC3=O)C5=CC=CO5

InChI

InChI=1S/C22H25N5O2S/c28-21-23-17-10-4-5-11-18(17)26(21)13-7-15-30-22-25-24-20(19-12-6-14-29-19)27(22)16-8-2-1-3-9-16/h4-6,10-12,14,16H,1-3,7-9,13,15H2,(H,23,28)