N-(6-bromanyl-1,3-benzothiazol-2-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1,3,5-trimethyl-4-pyrazolesulfonamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1,3,5-trimethylpyrazole-4-sulfonamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide Formula: C13H13BrN4O2S2 MolecularWeight: 401.30192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C13H13BrN4O2S2/c1-7-12(8(2)18(3)16-7)22(19,20)17-13-15-10-5-4-9(14)6-11(10)21-13/h4-6H,1-3H3,(H,15,17)