N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C23H22BrN5O2 MolecularWeight: 480.35708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4)C)Br

InChI

InChI=1S/C23H22BrN5O2/c1-16-22(24)17(2)29(26-16)14-18-7-6-8-19(13-18)25-23(30)21-11-12-28(27-21)15-31-20-9-4-3-5-10-20/h3-13H,14-15H2,1-2H3,(H,25,30)