N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-yl]sulfonylethyl]-9H-xanthene-9-carboxamide CAS Name: N-[2-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]ethyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-[4-(m-tolyl)piperazino]sulfonylethyl]-9H-xanthene-9-carboxamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O4S/c1-20-7-6-8-21(19-20)29-14-16-30(17-15-29)35(32,33)18-13-28-27(31)26-22-9-2-4-11-24(22)34-25-12-5-3-10-23(25)26/h2-12,19,26H,13-18H2,1H3,(H,28,31)