7-(4-bromanyl-1-ethyl-pyrazol-3-yl)-N-hexyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 7-(4-bromanyl-1-ethyl-pyrazol-3-yl)-N-hexyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 7-(4-bromo-1-ethyl-pyrazol-3-yl)-N-hexyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 7-(4-bromo-1-ethyl-3-pyrazolyl)-N-hexyl-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 7-(4-bromo-1-ethylpyrazol-3-yl)-N-hexylpyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 7-(4-bromo-1-ethyl-pyrazol-3-yl)-N-hexyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C18H23BrN6O MolecularWeight: 419.31882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=NN2C(=CC=NC2=C1)C3=NN(C=C3Br)CC

Isomeric SMILES

CCCCCCNC(=O)C1=NN2C(=CC=NC2=C1)C3=NN(C=C3Br)CC

InChI

InChI=1S/C18H23BrN6O/c1-3-5-6-7-9-21-18(26)14-11-16-20-10-8-15(25(16)22-14)17-13(19)12-24(4-2)23-17/h8,10-12H,3-7,9H2,1-2H3,(H,21,26)