N-cyclopentyl-2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidine-1-carbothioamide

Systemtic Name: N-cyclopentyl-2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidine-1-carbothioamide Openeye Name: N-cyclopentyl-2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidine-1-carbothioamide CAS Name: N-cyclopentyl-2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-cyclopentyl-2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidine-1-carbothioamide Traditional Name: N-cyclopentyl-2-[2-(4-mesylphenyl)acetyl]pyrazolidine-1-carbothioamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)N2CCCN2C(=S)NC3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)N2CCCN2C(=S)NC3CCCC3

InChI

InChI=1S/C18H25N3O3S2/c1-26(23,24)16-9-7-14(8-10-16)13-17(22)20-11-4-12-21(20)18(25)19-15-5-2-3-6-15/h7-10,15H,2-6,11-13H2,1H3,(H,19,25)