1-ethyl-5-piperidin-1-ylsulfonyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole

Systemtic Name: 1-ethyl-5-piperidin-1-ylsulfonyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole Openeye Name: 1-ethyl-5-(1-piperidylsulfonyl)-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole CAS Name: 1-ethyl-5-(1-piperidinylsulfonyl)-2-(1-pyrrolidin-1-iumylmethyl)benzimidazole IUPAC Name: 1-ethyl-5-piperidin-1-ylsulfonyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole Traditional Name: 1-ethyl-5-piperidinosulfonyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole Formula: C19H29N4O2S+ MolecularWeight: 377.52416

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+]4CCCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+]4CCCC4

InChI

InChI=1S/C19H28N4O2S/c1-2-23-18-9-8-16(26(24,25)22-12-4-3-5-13-22)14-17(18)20-19(23)15-21-10-6-7-11-21/h8-9,14H,2-7,10-13,15H2,1H3/p+1