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

Systemtic Name: N-methyl-1-pyridin-3-yl-N-[2-(pyridin-3-ylsulfonylamino)ethyl]cyclohexane-1-carbothioamide Openeye Name: N-methyl-1-(3-pyridyl)-N-[2-(3-pyridylsulfonylamino)ethyl]cyclohexanecarbothioamide CAS Name: N-methyl-1-(3-pyridinyl)-N-[2-(3-pyridinylsulfonylamino)ethyl]-1-cyclohexanecarbothioamide IUPAC Name: N-methyl-1-pyridin-3-yl-N-[2-(pyridin-3-ylsulfonylamino)ethyl]cyclohexane-1-carbothioamide Traditional Name: N-methyl-1-(3-pyridyl)-N-[2-(3-pyridylsulfonylamino)ethyl]cyclohexanecarbothioamide Formula: C20H26N4O2S2 MolecularWeight: 418.57604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O2S2/c1-24(14-13-23-28(25,26)18-8-6-12-22-16-18)19(27)20(9-3-2-4-10-20)17-7-5-11-21-15-17/h5-8,11-12,15-16,23H,2-4,9-10,13-14H2,1H3