2-(2-methylsulfonylphenyl)carbonyl-N-prop-2-enyl-pyrazolidine-1-carbothioamide

Systemtic Name: 2-(2-methylsulfonylphenyl)carbonyl-N-prop-2-enyl-pyrazolidine-1-carbothioamide Openeye Name: N-allyl-2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carbothioamide CAS Name: 2-[(2-methylsulfonylphenyl)-oxomethyl]-N-prop-2-enyl-1-pyrazolidinecarbothioamide IUPAC Name: 2-(2-methylsulfonylbenzoyl)-N-prop-2-enylpyrazolidine-1-carbothioamide Traditional Name: N-allyl-2-(2-mesylbenzoyl)pyrazolidine-1-carbothioamide Formula: C15H19N3O3S2 MolecularWeight: 353.45966

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=S)NCC=C

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=S)NCC=C

InChI

InChI=1S/C15H19N3O3S2/c1-3-9-16-15(22)18-11-6-10-17(18)14(19)12-7-4-5-8-13(12)23(2,20)21/h3-5,7-8H,1,6,9-11H2,2H3,(H,16,22)