2-(5,6-dimethyl-1-benzofuran-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-(5,6-dimethylbenzofuran-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide CAS Name: 2-(5,6-dimethyl-3-benzofuranyl)-N-[4-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-(5,6-dimethylbenzofuran-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Formula: C24H30N3O4S+ MolecularWeight: 456.5777

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=COC4=CC(=C(C=C43)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=COC4=CC(=C(C=C43)C)C

InChI

InChI=1S/C24H29N3O4S/c1-4-26-9-11-27(12-10-26)32(29,30)21-7-5-20(6-8-21)25-24(28)15-19-16-31-23-14-18(3)17(2)13-22(19)23/h5-8,13-14,16H,4,9-12,15H2,1-3H3,(H,25,28)/p+1