2-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxo-propyl]-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3-oxopropyl]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxopropyl]-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3-keto-propyl]-1-ethyl-benzimidazole-5-sulfonamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C25H30N4O5S/c1-2-28-21-8-7-18(35(26,31)32)16-19(21)27-24(28)10-11-25(30)29-12-3-5-20(29)17-6-9-22-23(15-17)34-14-4-13-33-22/h6-9,15-16,20H,2-5,10-14H2,1H3,(H2,26,31,32)