93674-97-6 Purity
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Specification
The molecular formula is C10H17N3O2S.
The synonyms of the compound are 936751-11-0, N-(Aminothioxomethyl)-5-oxo-1-propyl-2-pyrrolidineacetamide, N-Carbamothioyl-2-(5-oxo-1-propylpyrrolidin-2-yl)acetamide, and 2-Pyrrolidineacetamide, N-(aminothioxomethyl)-5-oxo-1-propyl-.
The molecular weight is 243.33 g/mol.
The IUPAC name of the compound is N-carbamothioyl-2-(5-oxo-1-propylpyrrolidin-2-yl)acetamide.
The InChI of the compound is InChI=1S/C10H17N3O2S/c1-2-5-13-7(3-4-9(13)15)6-8(14)12-10(11)16/h7H,2-6H2,1H3,(H3,11,12,14,16).
The InChIKey of the compound is CRPIDIWYUDKQPV-UHFFFAOYSA-N.
The canonical SMILES of the compound is CCCN1C(CCC1=O)CC(=O)NC(=S)N.
The CAS number of the compound is 936751-11-0.
The XLogP3-AA value of the compound is 0.4.
Yes, the compound is canonicalized.