1-[6-[bis(fluoranyl)methylsulfinyl]-2,2-dimethyl-3-oxidanyl-chromen-4-yl]-4-methyl-piperazin-2-one

Systemtic Name: 1-[6-[bis(fluoranyl)methylsulfinyl]-2,2-dimethyl-3-oxidanyl-chromen-4-yl]-4-methyl-piperazin-2-one Openeye Name: 1-[6-(difluoromethylsulfinyl)-3-hydroxy-2,2-dimethyl-chromen-4-yl]-4-methyl-piperazin-2-one CAS Name: 1-[6-(difluoromethylsulfinyl)-3-hydroxy-2,2-dimethyl-1-benzopyran-4-yl]-4-methyl-2-piperazinone IUPAC Name: 1-[6-(difluoromethylsulfinyl)-3-hydroxy-2,2-dimethylchromen-4-yl]-4-methylpiperazin-2-one Traditional Name: 1-[6-(difluoromethylsulfinyl)-3-hydroxy-2,2-dimethyl-chromen-4-yl]-4-methyl-piperazin-2-one Formula: C17H20F2N2O4S MolecularWeight: 386.413506

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C2=C(O1)C=CC(=C2)S(=O)C(F)F)N3CCN(CC3=O)C)O)C

Isomeric SMILES

CC1(C(=C(C2=C(O1)C=CC(=C2)S(=O)C(F)F)N3CCN(CC3=O)C)O)C

InChI

InChI=1S/C17H20F2N2O4S/c1-17(2)15(23)14(21-7-6-20(3)9-13(21)22)11-8-10(26(24)16(18)19)4-5-12(11)25-17/h4-5,8,16,23H,6-7,9H2,1-3H3