5-[[3-(4-methylpiperazin-1-yl)sulfonylphenyl]carbonylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[[3-(4-methylpiperazin-1-yl)sulfonylphenyl]carbonylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[3-(4-methylpiperazin-1-yl)sulfonylbenzoyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[[3-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-oxomethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[3-(4-methylpiperazin-1-yl)sulfonylbenzoyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[3-(4-methylpiperazino)sulfonylbenzoyl]amino]isophthalamide Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

InChI

InChI=1S/C20H23N5O5S/c1-24-5-7-25(8-6-24)31(29,30)17-4-2-3-13(12-17)20(28)23-16-10-14(18(21)26)9-15(11-16)19(22)27/h2-4,9-12H,5-8H2,1H3,(H2,21,26)(H2,22,27)(H,23,28)