N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylsulfonylethanoyl)pyrazolidine-1-carbothioamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylsulfonylethanoyl)pyrazolidine-1-carbothioamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylsulfonylacetyl)pyrazolidine-1-carbothioamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-(2-methylsulfonyl-1-oxoethyl)-1-pyrazolidinecarbothioamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methylsulfonylacetyl)pyrazolidine-1-carbothioamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(2-mesylacetyl)pyrazolidine-1-carbothioamide Formula: C15H25N3O3S2 MolecularWeight: 359.5073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC(=O)N1CCCN1C(=S)NCCC2=CCCCC2

Isomeric SMILES

CS(=O)(=O)CC(=O)N1CCCN1C(=S)NCCC2=CCCCC2

InChI

InChI=1S/C15H25N3O3S2/c1-23(20,21)12-14(19)17-10-5-11-18(17)15(22)16-9-8-13-6-3-2-4-7-13/h6H,2-5,7-12H2,1H3,(H,16,22)