N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]piazthiole-4-sulfonamide Formula: C16H10BrCl2N5O2S2 MolecularWeight: 519.2229

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=NN(C=C3Br)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=NN(C=C3Br)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C16H10BrCl2N5O2S2/c17-10-8-24(7-9-4-5-11(18)12(19)6-9)20-16(10)23-28(25,26)14-3-1-2-13-15(14)22-27-21-13/h1-6,8H,7H2,(H,20,23)