1-butyl-N,N-diethyl-2-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-N,N-diethyl-2-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-N,N-diethyl-2-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-N,N-diethyl-2-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-N,N-diethyl-2-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-N,N-diethyl-2-[(4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]benzimidazole-5-sulfonamide Formula: C24H30N5O3S2+ MolecularWeight: 500.6567

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=CC(=O)[N+]4=CC=CC=C4N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=CC(=O)[N+]4=CC=CC=C4N3

InChI

InChI=1S/C24H29N5O3S2/c1-4-7-13-28-21-12-11-19(34(31,32)27(5-2)6-3)16-20(21)26-24(28)33-17-18-15-23(30)29-14-9-8-10-22(29)25-18/h8-12,14-16H,4-7,13,17H2,1-3H3/p+1