1-(4-bromophenyl)-5-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-5-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-5-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-5-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-5-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-5-methyl-N-(3,4,5-trimethoxybenzyl)pyrazole-4-carboxamide Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrN3O4/c1-13-17(12-24-25(13)16-7-5-15(22)6-8-16)21(26)23-11-14-9-18(27-2)20(29-4)19(10-14)28-3/h5-10,12H,11H2,1-4H3,(H,23,26)