N-(2,6-dimethylphenyl)-2-oxidanylidene-pyrrolidine-1-carbothioamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-oxidanylidene-pyrrolidine-1-carbothioamide Openeye Name: N-(2,6-dimethylphenyl)-2-oxo-pyrrolidine-1-carbothioamide CAS Name: N-(2,6-dimethylphenyl)-2-oxo-1-pyrrolidinecarbothioamide IUPAC Name: N-(2,6-dimethylphenyl)-2-oxopyrrolidine-1-carbothioamide Traditional Name: N-(2,6-dimethylphenyl)-2-keto-pyrrolidine-1-carbothioamide Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)N2CCCC2=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N2CCCC2=O

InChI

InChI=1S/C13H16N2OS/c1-9-5-3-6-10(2)12(9)14-13(17)15-8-4-7-11(15)16/h3,5-6H,4,7-8H2,1-2H3,(H,14,17)