1-(4-bromophenyl)-5-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-5-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-5-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-5-methyl-N-[3-(1-pyrazolylmethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-5-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-5-methyl-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrazole-4-carboxamide Formula: C21H18BrN5O MolecularWeight: 436.30452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NC3=CC=CC(=C3)CN4C=CC=N4

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NC3=CC=CC(=C3)CN4C=CC=N4

InChI

InChI=1S/C21H18BrN5O/c1-15-20(13-24-27(15)19-8-6-17(22)7-9-19)21(28)25-18-5-2-4-16(12-18)14-26-11-3-10-23-26/h2-13H,14H2,1H3,(H,25,28)