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

Systemtic Name: ethyl 3-[[2-(furan-3-ylcarbonyl)pyrazolidin-1-yl]carbothioylamino]propanoate Openeye Name: ethyl 3-[[2-(furan-3-carbonyl)pyrazolidine-1-carbothioyl]amino]propanoate CAS Name: 3-[[[2-[3-furanyl(oxo)methyl]-1-pyrazolidinyl]-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(furan-3-carbonyl)pyrazolidine-1-carbothioyl]amino]propanoate Traditional Name: 3-[[2-(3-furoyl)pyrazolidine-1-carbothioyl]amino]propionic acid ethyl ester Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=S)N1CCCN1C(=O)C2=COC=C2

Isomeric SMILES

CCOC(=O)CCNC(=S)N1CCCN1C(=O)C2=COC=C2

InChI

InChI=1S/C14H19N3O4S/c1-2-21-12(18)4-6-15-14(22)17-8-3-7-16(17)13(19)11-5-9-20-10-11/h5,9-10H,2-4,6-8H2,1H3,(H,15,22)