[2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]amino]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-[4-(difluoromethylsulfanyl)anilino]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [2-[4-(difluoromethylthio)anilino]phenyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-[4-(difluoromethylsulfanyl)anilino]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [2-[4-(difluoromethylthio)anilino]phenyl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C19H22F2N3OS+ MolecularWeight: 378.459286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C19H21F2N3OS/c1-23-10-12-24(13-11-23)18(25)16-4-2-3-5-17(16)22-14-6-8-15(9-7-14)26-19(20)21/h2-9,19,22H,10-13H2,1H3/p+1