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

Systemtic Name: 1-(4-bromophenyl)-N-[[3-(methoxymethyl)phenyl]methyl]-5-methyl-pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-N-[[3-(methoxymethyl)phenyl]methyl]-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-N-[[3-(methoxymethyl)phenyl]methyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-[[3-(methoxymethyl)phenyl]methyl]-5-methylpyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-N-[3-(methoxymethyl)benzyl]-5-methyl-pyrazole-4-carboxamide Formula: C20H20BrN3O2 MolecularWeight: 414.2957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCC3=CC(=CC=C3)COC

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCC3=CC(=CC=C3)COC

InChI

InChI=1S/C20H20BrN3O2/c1-14-19(12-23-24(14)18-8-6-17(21)7-9-18)20(25)22-11-15-4-3-5-16(10-15)13-26-2/h3-10,12H,11,13H2,1-2H3,(H,22,25)