[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(2-phenylsulfanylethoxy)phenyl]methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(2-phenylsulfanylethoxy)phenyl]methanone Openeye Name: [4-(2-phenylsulfanylethoxy)phenyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[4-[2-(phenylthio)ethoxy]phenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(2-phenylsulfanylethoxy)phenyl]methanone Traditional Name: [4-[2-(phenylthio)ethoxy]phenyl]-(4-tosylpiperazino)methanone Formula: C26H28N2O4S2 MolecularWeight: 496.64152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OCCSC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O4S2/c1-21-7-13-25(14-8-21)34(30,31)28-17-15-27(16-18-28)26(29)22-9-11-23(12-10-22)32-19-20-33-24-5-3-2-4-6-24/h2-14H,15-20H2,1H3