4-[1-propyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[1-propyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-propyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-propyl-2-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-propyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-propyl-2-[(4-pyridin-1-ium-2-ylpiperazino)methyl]benzimidazol-5-yl]sulfonylmorpholine Formula: C24H33N6O3S+ MolecularWeight: 485.62222

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4CCN(CC4)C5=CC=CC=[NH+]5

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4CCN(CC4)C5=CC=CC=[NH+]5

InChI

InChI=1S/C24H32N6O3S/c1-2-9-30-22-7-6-20(34(31,32)29-14-16-33-17-15-29)18-21(22)26-24(30)19-27-10-12-28(13-11-27)23-5-3-4-8-25-23/h3-8,18H,2,9-17,19H2,1H3/p+1