N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-3-phenyl-propanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-3-phenyl-propanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-3-phenyl-propanamide CAS Name: N-[(2,1,3-benzothiadiazol-4-ylamino)-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-3-phenylpropanamide Traditional Name: 3-phenyl-N-(piazthiol-4-ylthiocarbamoyl)propionamide Formula: C16H14N4OS2 MolecularWeight: 342.43856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC=CC3=NSN=C32

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C16H14N4OS2/c21-14(10-9-11-5-2-1-3-6-11)18-16(22)17-12-7-4-8-13-15(12)20-23-19-13/h1-8H,9-10H2,(H2,17,18,21,22)