4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(3-methylsulfonylphenyl)benzamide

Systemtic Name: 4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(3-methylsulfonylphenyl)benzamide Openeye Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(3-methylsulfonylphenyl)benzamide CAS Name: 4-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-(3-methylsulfonylphenyl)benzamide IUPAC Name: 4-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(3-methylsulfonylphenyl)benzamide Traditional Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(3-mesylphenyl)benzamide Formula: C19H18BrN3O3S MolecularWeight: 448.33352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)C)C)Br

InChI

InChI=1S/C19H18BrN3O3S/c1-12-18(20)13(2)23(22-12)16-9-7-14(8-10-16)19(24)21-15-5-4-6-17(11-15)27(3,25)26/h4-11H,1-3H3,(H,21,24)