[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Openeye Name: [4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone CAS Name: [4-(3,4-difluorophenyl)sulfonyl-1-piperazinyl]-[2-(phenylthio)-3-pyridinyl]methanone IUPAC Name: [4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(3,4-difluorophenyl)sulfonylpiperazino]-[2-(phenylthio)-3-pyridyl]methanone Formula: C22H19F2N3O3S2 MolecularWeight: 475.531366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C22H19F2N3O3S2/c23-19-9-8-17(15-20(19)24)32(29,30)27-13-11-26(12-14-27)22(28)18-7-4-10-25-21(18)31-16-5-2-1-3-6-16/h1-10,15H,11-14H2