N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbonyl-1-benzofuran-2-carbohydrazide

Systemtic Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbonyl-1-benzofuran-2-carbohydrazide Openeye Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]benzofuran-2-carbohydrazide CAS Name: N'-[[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-oxomethyl]-2-benzofurancarbohydrazide IUPAC Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]-1-benzofuran-2-carbohydrazide Traditional Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]coumarilohydrazide Formula: C21H23N4O5S+ MolecularWeight: 443.49612

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N4O5S/c1-24-10-12-25(13-11-24)31(28,29)17-8-6-15(7-9-17)20(26)22-23-21(27)19-14-16-4-2-3-5-18(16)30-19/h2-9,14H,10-13H2,1H3,(H,22,26)(H,23,27)/p+1