N-[2-[[3,4-bis(fluoranyl)phenyl]sulfonylamino]ethyl]-N-methyl-1-pyridin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: N-[2-[[3,4-bis(fluoranyl)phenyl]sulfonylamino]ethyl]-N-methyl-1-pyridin-3-yl-cyclohexane-1-carbothioamide Openeye Name: N-[2-[(3,4-difluorophenyl)sulfonylamino]ethyl]-N-methyl-1-(3-pyridyl)cyclohexanecarbothioamide CAS Name: N-[2-[(3,4-difluorophenyl)sulfonylamino]ethyl]-N-methyl-1-(3-pyridinyl)-1-cyclohexanecarbothioamide IUPAC Name: N-[2-[(3,4-difluorophenyl)sulfonylamino]ethyl]-N-methyl-1-pyridin-3-ylcyclohexane-1-carbothioamide Traditional Name: N-[2-[(3,4-difluorophenyl)sulfonylamino]ethyl]-N-methyl-1-(3-pyridyl)cyclohexanecarbothioamide Formula: C21H25F2N3O2S2 MolecularWeight: 453.568906

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNS(=O)(=O)C1=CC(=C(C=C1)F)F)C(=S)C2(CCCCC2)C3=CN=CC=C3

Isomeric SMILES

CN(CCNS(=O)(=O)C1=CC(=C(C=C1)F)F)C(=S)C2(CCCCC2)C3=CN=CC=C3

InChI

InChI=1S/C21H25F2N3O2S2/c1-26(13-12-25-30(27,28)17-7-8-18(22)19(23)14-17)20(29)21(9-3-2-4-10-21)16-6-5-11-24-15-16/h5-8,11,14-15,25H,2-4,9-10,12-13H2,1H3