N-(2-ethanoylphenyl)pyrazolidine-1-carbothioamide

Systemtic Name: N-(2-ethanoylphenyl)pyrazolidine-1-carbothioamide Openeye Name: N-(2-acetylphenyl)pyrazolidine-1-carbothioamide CAS Name: N-(2-acetylphenyl)-1-pyrazolidinecarbothioamide IUPAC Name: N-(2-acetylphenyl)pyrazolidine-1-carbothioamide Traditional Name: N-(2-acetylphenyl)pyrazolidine-1-carbothioamide Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=S)N2CCCN2

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=S)N2CCCN2

InChI

InChI=1S/C12H15N3OS/c1-9(16)10-5-2-3-6-11(10)14-12(17)15-8-4-7-13-15/h2-3,5-6,13H,4,7-8H2,1H3,(H,14,17)