4-bromanyl-N-butyl-3-oxidanylidene-1,2-thiazole-2-carbothioamide

Systemtic Name: 4-bromanyl-N-butyl-3-oxidanylidene-1,2-thiazole-2-carbothioamide Openeye Name: 4-bromo-N-butyl-3-oxo-isothiazole-2-carbothioamide CAS Name: 4-bromo-N-butyl-3-oxo-2-isothiazolecarbothioamide IUPAC Name: 4-bromo-N-butyl-3-oxo-1,2-thiazole-2-carbothioamide Traditional Name: 4-bromo-N-butyl-3-keto-4-isothiazoline-2-carbothioamide Formula: C8H11BrN2OS2 MolecularWeight: 295.21974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1C(=O)C(=CS1)Br

Isomeric SMILES

CCCCNC(=S)N1C(=O)C(=CS1)Br

InChI

InChI=1S/C8H11BrN2OS2/c1-2-3-4-10-8(13)11-7(12)6(9)5-14-11/h5H,2-4H2,1H3,(H,10,13)