N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-1,3,5-trimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-1,3,5-trimethyl-pyrazole-4-sulfonamide Openeye Name: N-[4-bromo-1-(p-tolylmethyl)pyrazol-3-yl]-1,3,5-trimethyl-pyrazole-4-sulfonamide CAS Name: N-[4-bromo-1-[(4-methylphenyl)methyl]-3-pyrazolyl]-1,3,5-trimethyl-4-pyrazolesulfonamide IUPAC Name: N-[4-bromo-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-1,3,5-trimethylpyrazole-4-sulfonamide Traditional Name: N-[4-bromo-1-(4-methylbenzyl)pyrazol-3-yl]-1,3,5-trimethyl-pyrazole-4-sulfonamide Formula: C17H20BrN5O2S MolecularWeight: 438.342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)NS(=O)(=O)C3=C(N(N=C3C)C)C)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)NS(=O)(=O)C3=C(N(N=C3C)C)C)Br

InChI

InChI=1S/C17H20BrN5O2S/c1-11-5-7-14(8-6-11)9-23-10-15(18)17(20-23)21-26(24,25)16-12(2)19-22(4)13(16)3/h5-8,10H,9H2,1-4H3,(H,20,21)