4-bromanyl-2-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide Traditional Name: 4-bromo-N-(6-mesyl-1,3-benzothiazol-2-yl)-2-methyl-pyrazole-3-carboxamide Formula: C13H11BrN4O3S2 MolecularWeight: 415.28544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN1C(=C(C=N1)Br)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C13H11BrN4O3S2/c1-18-11(8(14)6-15-18)12(19)17-13-16-9-4-3-7(23(2,20)21)5-10(9)22-13/h3-6H,1-2H3,(H,16,17,19)