[2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: [2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [2-chloro-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: [2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-phenyl]-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C22H30ClN5O3S+2 MolecularWeight: 480.0233

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C22H28ClN5O3S/c1-2-25-9-15-28(16-10-25)32(30,31)18-6-7-20(23)19(17-18)22(29)27-13-11-26(12-14-27)21-5-3-4-8-24-21/h3-8,17H,2,9-16H2,1H3/p+2