1-(4-bromophenyl)-5-methyl-N-(3-phenylmethoxypropyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-5-methyl-N-(3-phenylmethoxypropyl)pyrazole-4-carboxamide Openeye Name: N-(3-benzyloxypropyl)-1-(4-bromophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-5-methyl-N-(3-phenylmethoxypropyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-5-methyl-N-(3-phenylmethoxypropyl)pyrazole-4-carboxamide Traditional Name: N-(3-benzoxypropyl)-1-(4-bromophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C21H22BrN3O2/c1-16-20(14-24-25(16)19-10-8-18(22)9-11-19)21(26)23-12-5-13-27-15-17-6-3-2-4-7-17/h2-4,6-11,14H,5,12-13,15H2,1H3,(H,23,26)