4-[(4-bromanylpyrazol-1-yl)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-[(4-bromanylpyrazol-1-yl)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[(4-bromo-1-pyrazolyl)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-(6-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C19H15BrN4O3S2 MolecularWeight: 491.3814

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C19H15BrN4O3S2/c1-29(26,27)15-6-7-16-17(8-15)28-19(22-16)23-18(25)13-4-2-12(3-5-13)10-24-11-14(20)9-21-24/h2-9,11H,10H2,1H3,(H,22,23,25)