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

Systemtic Name: ethyl 3-[[2-(furan-2-ylmethylcarbamothioyl)pyrazolidin-1-yl]carbothioylamino]propanoate Openeye Name: ethyl 3-[[2-(2-furylmethylcarbamothioyl)pyrazolidine-1-carbothioyl]amino]propanoate CAS Name: 3-[[[2-[(2-furanylmethylamino)-sulfanylidenemethyl]-1-pyrazolidinyl]-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(furan-2-ylmethylcarbamothioyl)pyrazolidine-1-carbothioyl]amino]propanoate Traditional Name: 3-[[2-(2-furfurylthiocarbamoyl)pyrazolidine-1-carbothioyl]amino]propionic acid ethyl ester Formula: C15H22N4O3S2 MolecularWeight: 370.49018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=S)N1CCCN1C(=S)NCC2=CC=CO2

Isomeric SMILES

CCOC(=O)CCNC(=S)N1CCCN1C(=S)NCC2=CC=CO2

InChI

InChI=1S/C15H22N4O3S2/c1-2-21-13(20)6-7-16-14(23)18-8-4-9-19(18)15(24)17-11-12-5-3-10-22-12/h3,5,10H,2,4,6-9,11H2,1H3,(H,16,23)(H,17,24)