1-(4-bromophenyl)-5-methyl-N-[2-(3-methylphenoxy)ethyl]pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-5-methyl-N-[2-(3-methylphenoxy)ethyl]pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-5-methyl-N-[2-(3-methylphenoxy)ethyl]pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-5-methyl-N-[2-(3-methylphenoxy)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-5-methyl-N-[2-(3-methylphenoxy)ethyl]pyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-5-methyl-N-[2-(3-methylphenoxy)ethyl]pyrazole-4-carboxamide Formula: C20H20BrN3O2 MolecularWeight: 414.2957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Br)C

InChI

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