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

Systemtic Name: N-ethyl-N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-1-pyridin-3-yl-cyclohexane-1-carbothioamide Openeye Name: N-ethyl-N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-1-(3-pyridyl)cyclohexanecarbothioamide CAS Name: N-ethyl-N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-1-(3-pyridinyl)-1-cyclohexanecarbothioamide IUPAC Name: N-ethyl-N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-1-pyridin-3-ylcyclohexane-1-carbothioamide Traditional Name: N-ethyl-N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-1-(3-pyridyl)cyclohexanecarbothioamide Formula: C22H28FN3O2S2 MolecularWeight: 449.605023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28FN3O2S2/c1-2-26(16-15-25-30(27,28)20-10-8-19(23)9-11-20)21(29)22(12-4-3-5-13-22)18-7-6-14-24-17-18/h6-11,14,17,25H,2-5,12-13,15-16H2,1H3