ethyl 3-[[2-(2-methylpropanoyl)pyrazolidin-1-yl]carbothioylamino]propanoate

Systemtic Name: ethyl 3-[[2-(2-methylpropanoyl)pyrazolidin-1-yl]carbothioylamino]propanoate Openeye Name: ethyl 3-[[2-(2-methylpropanoyl)pyrazolidine-1-carbothioyl]amino]propanoate CAS Name: 3-[[[2-(2-methyl-1-oxopropyl)-1-pyrazolidinyl]-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-methylpropanoyl)pyrazolidine-1-carbothioyl]amino]propanoate Traditional Name: 3-[(2-isobutyrylpyrazolidine-1-carbothioyl)amino]propionic acid ethyl ester Formula: C13H23N3O3S MolecularWeight: 301.40502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=S)N1CCCN1C(=O)C(C)C

Isomeric SMILES

CCOC(=O)CCNC(=S)N1CCCN1C(=O)C(C)C

InChI

InChI=1S/C13H23N3O3S/c1-4-19-11(17)6-7-14-13(20)16-9-5-8-15(16)12(18)10(2)3/h10H,4-9H2,1-3H3,(H,14,20)