N-[3-[4-(3-methylphenyl)piperazin-1-yl]sulfonylpropyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]sulfonylpropyl]-9H-xanthene-9-carboxamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]sulfonylpropyl]-9H-xanthene-9-carboxamide CAS Name: N-[3-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]propyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]sulfonylpropyl]-9H-xanthene-9-carboxamide Traditional Name: N-[3-[4-(m-tolyl)piperazino]sulfonylpropyl]-9H-xanthene-9-carboxamide Formula: C28H31N3O4S MolecularWeight: 505.62844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCCNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCCNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C28H31N3O4S/c1-21-8-6-9-22(20-21)30-15-17-31(18-16-30)36(33,34)19-7-14-29-28(32)27-23-10-2-4-12-25(23)35-26-13-5-3-11-24(26)27/h2-6,8-13,20,27H,7,14-19H2,1H3,(H,29,32)