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

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]piazthiole-4-sulfonamide Formula: C16H12BrN5O2S2 MolecularWeight: 450.33278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C16H12BrN5O2S2/c17-12-6-4-11(5-7-12)9-22-10-13(8-18-22)21-26(23,24)15-3-1-2-14-16(15)20-25-19-14/h1-8,10,21H,9H2