2-(2-methylsulfonylphenyl)carbonyl-N-propan-2-yl-pyrazolidine-1-carbothioamide

Systemtic Name: 2-(2-methylsulfonylphenyl)carbonyl-N-propan-2-yl-pyrazolidine-1-carbothioamide Openeye Name: N-isopropyl-2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carbothioamide CAS Name: 2-[(2-methylsulfonylphenyl)-oxomethyl]-N-propan-2-yl-1-pyrazolidinecarbothioamide IUPAC Name: 2-(2-methylsulfonylbenzoyl)-N-propan-2-ylpyrazolidine-1-carbothioamide Traditional Name: N-isopropyl-2-(2-mesylbenzoyl)pyrazolidine-1-carbothioamide Formula: C15H21N3O3S2 MolecularWeight: 355.47554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)N1CCCN1C(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC(C)NC(=S)N1CCCN1C(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C15H21N3O3S2/c1-11(2)16-15(22)18-10-6-9-17(18)14(19)12-7-4-5-8-13(12)23(3,20)21/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,16,22)