N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-1-(phenoxymethyl)pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-(phenoxymethyl)pyrazole-3-carboxamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-1-(phenoxymethyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-(phenoxymethyl)pyrazole-3-carboxamide Formula: C19H22BrN5O2 MolecularWeight: 432.31428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNC(=O)C2=NN(C=C2)COC3=CC=CC=C3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNC(=O)C2=NN(C=C2)COC3=CC=CC=C3)C)Br

InChI

InChI=1S/C19H22BrN5O2/c1-14-18(20)15(2)25(22-14)11-6-10-21-19(26)17-9-12-24(23-17)13-27-16-7-4-3-5-8-16/h3-5,7-9,12H,6,10-11,13H2,1-2H3,(H,21,26)