2-[2-(azetidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[2-(azetidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[2-(azetidin-1-yl)-2-oxo-ethyl]sulfanyl-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[2-(1-azetidinyl)-2-oxoethyl]thio]-1-butyl-N,N-diethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[2-(azetidin-1-yl)-2-oxoethyl]sulfanyl-1-butyl-N,N-diethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-(azetidin-1-yl)-2-keto-ethyl]thio]-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide Formula: C20H30N4O3S2 MolecularWeight: 438.6072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)N3CCC3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)N3CCC3

InChI

InChI=1S/C20H30N4O3S2/c1-4-7-13-24-18-10-9-16(29(26,27)23(5-2)6-3)14-17(18)21-20(24)28-15-19(25)22-11-8-12-22/h9-10,14H,4-8,11-13,15H2,1-3H3