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

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C24H24BrN5O MolecularWeight: 478.38426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C)Br

InChI

InChI=1S/C24H24BrN5O/c1-17-22(25)18(2)29(27-17)15-9-14-26-24(31)21-16-30(20-12-7-4-8-13-20)28-23(21)19-10-5-3-6-11-19/h3-8,10-13,16H,9,14-15H2,1-2H3,(H,26,31)