[5-[(2-methylphenyl)sulfonylmethyl]furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [5-[(2-methylphenyl)sulfonylmethyl]furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[5-(o-tolylsulfonylmethyl)-2-furyl]methanone CAS Name: [5-[(2-methylphenyl)sulfonylmethyl]-2-furanyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[5-[(2-methylphenyl)sulfonylmethyl]furan-2-yl]methanone Traditional Name: (4-benzylpiperazino)-[5-(o-tolylsulfonylmethyl)-2-furyl]methanone Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4S/c1-19-7-5-6-10-23(19)31(28,29)18-21-11-12-22(30-21)24(27)26-15-13-25(14-16-26)17-20-8-3-2-4-9-20/h2-12H,13-18H2,1H3