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

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-1-[(4-chloranylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-[(4-chlorophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-1-[(4-chlorophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-1-[(4-chlorophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-[(4-chlorophenoxy)methyl]pyrazole-3-carboxamide Formula: C19H21BrClN5O2 MolecularWeight: 466.75934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrClN5O2/c1-13-18(20)14(2)26(23-13)10-3-9-22-19(27)17-8-11-25(24-17)12-28-16-6-4-15(21)5-7-16/h4-8,11H,3,9-10,12H2,1-2H3,(H,22,27)