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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)Br)C

Isomeric SMILES

CCN1C(=C(C=N1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)Br)C

InChI

InChI=1S/C13H13BrN4O2S2/c1-3-18-8(2)12(7-15-18)22(19,20)17-13-16-10-5-4-9(14)6-11(10)21-13/h4-7H,3H2,1-2H3,(H,16,17)