N-[2-(4-bromanylphenoxy)ethyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[2-(4-bromanylphenoxy)ethyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-3-(1-phenylpyrazol-4-yl)propionamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Br)C(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Br)C(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

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