ethyl 2-[[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]carbothioylamino]ethanoate

Systemtic Name: ethyl 2-[[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]carbothioylamino]ethanoate Openeye Name: ethyl 2-[[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidine-1-carbothioyl]amino]acetate CAS Name: 2-[[[2-[2,1,3-benzoxadiazol-5-yl(oxo)methyl]-1-pyrazolidinyl]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidine-1-carbothioyl]amino]acetate Traditional Name: 2-[[2-(benzofurazan-5-carbonyl)pyrazolidine-1-carbothioyl]amino]acetic acid ethyl ester Formula: C15H17N5O4S MolecularWeight: 363.39158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

Isomeric SMILES

CCOC(=O)CNC(=S)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

InChI

InChI=1S/C15H17N5O4S/c1-2-23-13(21)9-16-15(25)20-7-3-6-19(20)14(22)10-4-5-11-12(8-10)18-24-17-11/h4-5,8H,2-3,6-7,9H2,1H3,(H,16,25)