N-ethyl-N-[2-(phenylsulfonylamino)ethyl]-1-pyridin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: N-ethyl-N-[2-(phenylsulfonylamino)ethyl]-1-pyridin-3-yl-cyclohexane-1-carbothioamide Openeye Name: N-[2-(benzenesulfonamido)ethyl]-N-ethyl-1-(3-pyridyl)cyclohexanecarbothioamide CAS Name: N-[2-(benzenesulfonamido)ethyl]-N-ethyl-1-(3-pyridinyl)-1-cyclohexanecarbothioamide IUPAC Name: N-[2-(benzenesulfonamido)ethyl]-N-ethyl-1-pyridin-3-ylcyclohexane-1-carbothioamide Traditional Name: N-[2-(benzenesulfonamido)ethyl]-N-ethyl-1-(3-pyridyl)cyclohexanecarbothioamide Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O2S2/c1-2-25(17-16-24-29(26,27)20-11-5-3-6-12-20)21(28)22(13-7-4-8-14-22)19-10-9-15-23-18-19/h3,5-6,9-12,15,18,24H,2,4,7-8,13-14,16-17H2,1H3