4-methyl-N-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]benzenesulfonamide Traditional Name: 4-methyl-N-[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]benzenesulfonamide Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C31H29N3O4S/c1-22-10-16-25(17-11-22)39(36,37)32-23-12-14-24(15-13-23)33-18-20-34(21-19-33)31(35)30-26-6-2-4-8-28(26)38-29-9-5-3-7-27(29)30/h2-17,30,32H,18-21H2,1H3