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

Systemtic Name: [3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [3-(4-fluorophenyl)-2-thioxo-1H-imidazol-4-yl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazol-4-yl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazol-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [3-(4-fluorophenyl)-2-thioxo-4-imidazolin-4-yl]-(4-tosylpiperazino)methanone Formula: C21H21FN4O3S2 MolecularWeight: 460.544843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21FN4O3S2/c1-15-2-8-18(9-3-15)31(28,29)25-12-10-24(11-13-25)20(27)19-14-23-21(30)26(19)17-6-4-16(22)5-7-17/h2-9,14H,10-13H2,1H3,(H,23,30)