3-bromanyl-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: 3-bromo-N-[[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C15H10BrN3O2S2 MolecularWeight: 408.2928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O

InChI

InChI=1S/C15H10BrN3O2S2/c16-9-3-1-2-8(6-9)13(21)18-14(22)19-15-17-11-5-4-10(20)7-12(11)23-15/h1-7,20H,(H2,17,18,19,21,22)