1-ethyl-2-[[(2R)-oxan-2-yl]methylsulfanyl]-5-piperidin-1-ylsulfonyl-benzimidazole

Systemtic Name: 1-ethyl-2-[[(2R)-oxan-2-yl]methylsulfanyl]-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 1-ethyl-5-(1-piperidylsulfonyl)-2-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]benzimidazole CAS Name: 1-ethyl-2-[[(2R)-2-oxanyl]methylthio]-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 1-ethyl-2-[[(2R)-oxan-2-yl]methylsulfanyl]-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 1-ethyl-5-piperidinosulfonyl-2-[[(2R)-tetrahydropyran-2-yl]methylthio]benzimidazole Formula: C20H29N3O3S2 MolecularWeight: 423.59256

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4CCCCO4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SC[C@H]4CCCCO4

InChI

InChI=1S/C20H29N3O3S2/c1-2-23-19-10-9-17(28(24,25)22-11-5-3-6-12-22)14-18(19)21-20(23)27-15-16-8-4-7-13-26-16/h9-10,14,16H,2-8,11-13,15H2,1H3/t16-/m1/s1