N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-pyrrolidinosulfonyl-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=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

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

InChI

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