3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C22H29N4O5S2+ MolecularWeight: 493.61946

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H28N4O5S2/c1-24-13-15-26(16-14-24)33(30,31)21-6-4-5-18(17-21)22(27)23-19-7-9-20(10-8-19)32(28,29)25-11-2-3-12-25/h4-10,17H,2-3,11-16H2,1H3,(H,23,27)/p+1