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

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-1-(1-pyrazolylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Formula: C16H20BrN7O MolecularWeight: 406.2803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNC(=O)C2=NN(C=C2)CN3C=CC=N3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNC(=O)C2=NN(C=C2)CN3C=CC=N3)C)Br

InChI

InChI=1S/C16H20BrN7O/c1-12-15(17)13(2)24(20-12)9-3-6-18-16(25)14-5-10-23(21-14)11-22-8-4-7-19-22/h4-5,7-8,10H,3,6,9,11H2,1-2H3,(H,18,25)