1-butyl-2-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl]thio]benzimidazole-5-sulfonamide Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C=C3C(C4=CC=CC=C4N3C)(C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C=C3C(C4=CC=CC=C4N3C)(C)C

InChI

InChI=1S/C25H30N4O3S2/c1-5-6-13-29-22-12-11-18(34(26,31)32)15-20(22)27-24(29)33-16-17(30)14-23-25(2,3)19-9-7-8-10-21(19)28(23)4/h7-12,14-15H,5-6,13,16H2,1-4H3,(H2,26,31,32)