N-[2-(4-methylsulfonylpiperazin-1-yl)sulfonylethyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[2-(4-methylsulfonylpiperazin-1-yl)sulfonylethyl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-(4-methylsulfonylpiperazin-1-yl)sulfonylethyl]-9H-xanthene-9-carboxamide CAS Name: N-[2-[(4-methylsulfonyl-1-piperazinyl)sulfonyl]ethyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[2-(4-methylsulfonylpiperazin-1-yl)sulfonylethyl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-(4-mesylpiperazino)sulfonylethyl]-9H-xanthene-9-carboxamide Formula: C21H25N3O6S2 MolecularWeight: 479.5697

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)S(=O)(=O)CCNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)S(=O)(=O)CCNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C21H25N3O6S2/c1-31(26,27)23-11-13-24(14-12-23)32(28,29)15-10-22-21(25)20-16-6-2-4-8-18(16)30-19-9-5-3-7-17(19)20/h2-9,20H,10-15H2,1H3,(H,22,25)