5-methyl-3-oxidanylidene-N-phenyl-pyrazolidine-1-carbothioamide

Systemtic Name: 5-methyl-3-oxidanylidene-N-phenyl-pyrazolidine-1-carbothioamide Openeye Name: 5-methyl-3-oxo-N-phenyl-pyrazolidine-1-carbothioamide CAS Name: 5-methyl-3-oxo-N-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: 5-methyl-3-oxo-N-phenylpyrazolidine-1-carbothioamide Traditional Name: 3-keto-5-methyl-N-phenyl-pyrazolidine-1-carbothioamide Formula: C11H13N3OS MolecularWeight: 235.30542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN1C(=S)NC2=CC=CC=C2

Isomeric SMILES

CC1CC(=O)NN1C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C11H13N3OS/c1-8-7-10(15)13-14(8)11(16)12-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,16)(H,13,15)