3-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-5-(furan-2-yl)-1,2-oxazole

Systemtic Name: 3-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-5-(furan-2-yl)-1,2-oxazole Openeye Name: 3-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanylmethyl]-5-(2-furyl)isoxazole CAS Name: 3-[[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]methyl]-5-(2-furanyl)isoxazole IUPAC Name: 3-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylmethyl]-5-(furan-2-yl)-1,2-oxazole Traditional Name: 3-[[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]methyl]-5-(2-furyl)isoxazole Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=NOC(=C4)C5=CC=CO5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=NOC(=C4)C5=CC=CO5

InChI

InChI=1S/C22H24N4O4S2/c1-2-26-19-9-8-17(32(27,28)25-10-4-3-5-11-25)14-18(19)23-22(26)31-15-16-13-21(30-24-16)20-7-6-12-29-20/h6-9,12-14H,2-5,10-11,15H2,1H3