N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]hexanamide

Systemtic Name: N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]hexanamide Openeye Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]hexanamide CAS Name: N-[[(5-chloro-2,1,3-benzothiadiazol-4-yl)amino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]hexanamide Traditional Name: N-[(5-chloropiazthiol-4-yl)thiocarbamoyl]hexanamide Formula: C13H15ClN4OS2 MolecularWeight: 342.8674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=C(C=CC2=NSN=C21)Cl

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=C(C=CC2=NSN=C21)Cl

InChI

InChI=1S/C13H15ClN4OS2/c1-2-3-4-5-10(19)15-13(20)16-11-8(14)6-7-9-12(11)18-21-17-9/h6-7H,2-5H2,1H3,(H2,15,16,19,20)