N-[(5-bromanyl-1,3-benzothiazol-2-yl)carbamothioyl]butanamide

Systemtic Name: N-[(5-bromanyl-1,3-benzothiazol-2-yl)carbamothioyl]butanamide Openeye Name: N-[(5-bromo-1,3-benzothiazol-2-yl)carbamothioyl]butanamide CAS Name: N-[[(5-bromo-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[(5-bromo-1,3-benzothiazol-2-yl)carbamothioyl]butanamide Traditional Name: N-[(5-bromo-1,3-benzothiazol-2-yl)thiocarbamoyl]butyramide Formula: C12H12BrN3OS2 MolecularWeight: 358.27718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NC1=NC2=C(S1)C=CC(=C2)Br

Isomeric SMILES

CCCC(=O)NC(=S)NC1=NC2=C(S1)C=CC(=C2)Br

InChI

InChI=1S/C12H12BrN3OS2/c1-2-3-10(17)15-11(18)16-12-14-8-6-7(13)4-5-9(8)19-12/h4-6H,2-3H2,1H3,(H2,14,15,16,17,18)