cyclopropyl-[4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: cyclopropyl-[4-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: cyclopropyl-[4-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]piperazin-4-ium-1-yl]methanone CAS Name: cyclopropyl-[4-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: cyclopropyl-[4-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: cyclopropyl-[4-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Formula: C23H34N5O3S+ MolecularWeight: 460.61276

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+]4CCN(CC4)C(=O)C5CC5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C[NH+]4CCN(CC4)C(=O)C5CC5

InChI

InChI=1S/C23H33N5O3S/c1-2-28-21-9-8-19(32(30,31)27-10-4-3-5-11-27)16-20(21)24-22(28)17-25-12-14-26(15-13-25)23(29)18-6-7-18/h8-9,16,18H,2-7,10-15,17H2,1H3/p+1