2-chloranyl-N-[(6-chloranyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-5-iodanyl-benzamide

Systemtic Name: 2-chloranyl-N-[(6-chloranyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-5-iodanyl-benzamide Openeye Name: 2-chloro-N-[(6-chloro-2-phenyl-benzotriazol-5-yl)carbamothioyl]-5-iodo-benzamide CAS Name: 2-chloro-N-[[(6-chloro-2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-5-iodobenzamide IUPAC Name: 2-chloro-N-[(6-chloro-2-phenylbenzotriazol-5-yl)carbamothioyl]-5-iodobenzamide Traditional Name: 2-chloro-N-[(6-chloro-2-phenyl-benzotriazol-5-yl)thiocarbamoyl]-5-iodo-benzamide Formula: C20H12Cl2IN5OS MolecularWeight: 568.21765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=C(C=CC(=C4)I)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=C(C=CC(=C4)I)Cl

InChI

InChI=1S/C20H12Cl2IN5OS/c21-14-7-6-11(23)8-13(14)19(29)25-20(30)24-16-10-18-17(9-15(16)22)26-28(27-18)12-4-2-1-3-5-12/h1-10H,(H2,24,25,29,30)