2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[2-(3,5-dimethyl-1-piperidyl)-1-methyl-2-oxo-ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[1-(3,5-dimethyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-(3,5-dimethylpiperidino)-2-keto-1-methyl-ethyl]thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C20H30N4O3S2 MolecularWeight: 438.6072

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)N3CC(CC(C3)C)C

InChI

InChI=1S/C20H30N4O3S2/c1-5-8-24-18-7-6-16(29(21,26)27)10-17(18)22-20(24)28-15(4)19(25)23-11-13(2)9-14(3)12-23/h6-7,10,13-15H,5,8-9,11-12H2,1-4H3,(H2,21,26,27)