3-(4-bromophenyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-[1-(4-mesylphenyl)ethyl]-1H-pyrazole-5-carboxamide Formula: C19H18BrN3O3S MolecularWeight: 448.33352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrN3O3S/c1-12(13-5-9-16(10-6-13)27(2,25)26)21-19(24)18-11-17(22-23-18)14-3-7-15(20)8-4-14/h3-12H,1-2H3,(H,21,24)(H,22,23)