ethyl 5-(3-chloranyl-2-methyl-phenyl)-6-(3-methoxypropylcarbamoyl)-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate

Systemtic Name: ethyl 5-(3-chloranyl-2-methyl-phenyl)-6-(3-methoxypropylcarbamoyl)-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Openeye Name: ethyl 5-(3-chloro-2-methyl-phenyl)-6-(3-methoxypropylcarbamoyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate CAS Name: 5-(3-chloro-2-methylphenyl)-6-[(3-methoxypropylamino)-oxomethyl]-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-chloro-2-methylphenyl)-6-(3-methoxypropylcarbamoyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Traditional Name: 5-(3-chloro-2-methyl-phenyl)-4-keto-6-(3-methoxypropylcarbamoyl)-6-methyl-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid ethyl ester Formula: C22H27ClN4O5 MolecularWeight: 462.92658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN2CC(N(C(=O)C2=C1)C3=C(C(=CC=C3)Cl)C)(C)C(=O)NCCCOC

Isomeric SMILES

CCOC(=O)C1=NN2CC(N(C(=O)C2=C1)C3=C(C(=CC=C3)Cl)C)(C)C(=O)NCCCOC

InChI

InChI=1S/C22H27ClN4O5/c1-5-32-20(29)16-12-18-19(28)27(17-9-6-8-15(23)14(17)2)22(3,13-26(18)25-16)21(30)24-10-7-11-31-4/h6,8-9,12H,5,7,10-11,13H2,1-4H3,(H,24,30)