7-(1-ethyl-5-methyl-pyrazol-4-yl)-N-octadecyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 7-(1-ethyl-5-methyl-pyrazol-4-yl)-N-octadecyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 7-(1-ethyl-5-methyl-pyrazol-4-yl)-N-octadecyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 7-(1-ethyl-5-methyl-4-pyrazolyl)-N-octadecyl-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 7-(1-ethyl-5-methylpyrazol-4-yl)-N-octadecylpyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 7-(1-ethyl-5-methyl-pyrazol-4-yl)-N-stearyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C31H50N6O MolecularWeight: 522.7683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN2C(=CC=NC2=C1)C3=C(N(N=C3)CC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN2C(=CC=NC2=C1)C3=C(N(N=C3)CC)C

InChI

InChI=1S/C31H50N6O/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-33-31(38)28-24-30-32-23-21-29(37(30)35-28)27-25-34-36(5-2)26(27)3/h21,23-25H,4-20,22H2,1-3H3,(H,33,38)