ethyl 6-(cyclooctylcarbamoyl)-5-(4-fluoranyl-2-methyl-phenyl)-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate

Systemtic Name: ethyl 6-(cyclooctylcarbamoyl)-5-(4-fluoranyl-2-methyl-phenyl)-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Openeye Name: ethyl 6-(cyclooctylcarbamoyl)-5-(4-fluoro-2-methyl-phenyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate CAS Name: 6-[(cyclooctylamino)-oxomethyl]-5-(4-fluoro-2-methylphenyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(cyclooctylcarbamoyl)-5-(4-fluoro-2-methylphenyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Traditional Name: 6-(cyclooctylcarbamoyl)-5-(4-fluoro-2-methyl-phenyl)-4-keto-6-methyl-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid ethyl ester Formula: C26H33FN4O4 MolecularWeight: 484.563023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN2CC(N(C(=O)C2=C1)C3=C(C=C(C=C3)F)C)(C)C(=O)NC4CCCCCCC4

Isomeric SMILES

CCOC(=O)C1=NN2CC(N(C(=O)C2=C1)C3=C(C=C(C=C3)F)C)(C)C(=O)NC4CCCCCCC4

InChI

InChI=1S/C26H33FN4O4/c1-4-35-24(33)20-15-22-23(32)31(21-13-12-18(27)14-17(21)2)26(3,16-30(22)29-20)25(34)28-19-10-8-6-5-7-9-11-19/h12-15,19H,4-11,16H2,1-3H3,(H,28,34)