[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [3-(4-fluorophenyl)-2-methylsulfanylimidazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [3-(4-fluorophenyl)-2-(methylthio)imidazol-4-yl]-(4-tosylpiperazino)methanone Formula: C22H23FN4O3S2 MolecularWeight: 474.571423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

InChI

InChI=1S/C22H23FN4O3S2/c1-16-3-9-19(10-4-16)32(29,30)26-13-11-25(12-14-26)21(28)20-15-24-22(31-2)27(20)18-7-5-17(23)6-8-18/h3-10,15H,11-14H2,1-2H3