2-(2,1,3-benzoxadiazol-5-ylcarbonyl)-N-propan-2-yl-pyrazolidine-1-carbothioamide

Systemtic Name: 2-(2,1,3-benzoxadiazol-5-ylcarbonyl)-N-propan-2-yl-pyrazolidine-1-carbothioamide Openeye Name: 2-(2,1,3-benzoxadiazole-5-carbonyl)-N-isopropyl-pyrazolidine-1-carbothioamide CAS Name: 2-[2,1,3-benzoxadiazol-5-yl(oxo)methyl]-N-propan-2-yl-1-pyrazolidinecarbothioamide IUPAC Name: 2-(2,1,3-benzoxadiazole-5-carbonyl)-N-propan-2-ylpyrazolidine-1-carbothioamide Traditional Name: 2-(benzofurazan-5-carbonyl)-N-isopropyl-pyrazolidine-1-carbothioamide Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

Isomeric SMILES

CC(C)NC(=S)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

InChI

InChI=1S/C14H17N5O2S/c1-9(2)15-14(22)19-7-3-6-18(19)13(20)10-4-5-11-12(8-10)17-21-16-11/h4-5,8-9H,3,6-7H2,1-2H3,(H,15,22)