2-[1-[(4-fluorophenyl)sulfonylamino]ethyl]-N-methyl-1-pyridin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: 2-[1-[(4-fluorophenyl)sulfonylamino]ethyl]-N-methyl-1-pyridin-3-yl-cyclohexane-1-carbothioamide Openeye Name: 2-[1-[(4-fluorophenyl)sulfonylamino]ethyl]-N-methyl-1-(3-pyridyl)cyclohexanecarbothioamide CAS Name: 2-[1-[(4-fluorophenyl)sulfonylamino]ethyl]-N-methyl-1-(3-pyridinyl)-1-cyclohexanecarbothioamide IUPAC Name: 2-[1-[(4-fluorophenyl)sulfonylamino]ethyl]-N-methyl-1-pyridin-3-ylcyclohexane-1-carbothioamide Traditional Name: 2-[1-[(4-fluorophenyl)sulfonylamino]ethyl]-N-methyl-1-(3-pyridyl)cyclohexanecarbothioamide Formula: C21H26FN3O2S2 MolecularWeight: 435.578443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1(C2=CN=CC=C2)C(=S)NC)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C1CCCCC1(C2=CN=CC=C2)C(=S)NC)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O2S2/c1-15(25-29(26,27)18-10-8-17(22)9-11-18)19-7-3-4-12-21(19,20(28)23-2)16-6-5-13-24-14-16/h5-6,8-11,13-15,19,25H,3-4,7,12H2,1-2H3,(H,23,28)