N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbonyl-2,3-dihydro-1-benzofuran-5-carbohydrazide

Systemtic Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbonyl-2,3-dihydro-1-benzofuran-5-carbohydrazide Openeye Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]-2,3-dihydrobenzofuran-5-carbohydrazide CAS Name: N'-[[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-oxomethyl]-2,3-dihydrobenzofuran-5-carbohydrazide IUPAC Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]-2,3-dihydro-1-benzofuran-5-carbohydrazide Traditional Name: N'-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]coumaran-5-carbohydrazide Formula: C21H25N4O5S+ MolecularWeight: 445.512

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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=C(C=C3)OCC4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C21H24N4O5S/c1-24-9-11-25(12-10-24)31(28,29)18-5-2-15(3-6-18)20(26)22-23-21(27)17-4-7-19-16(14-17)8-13-30-19/h2-7,14H,8-13H2,1H3,(H,22,26)(H,23,27)/p+1