ethyl 3,5-dimethyl-1-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-1-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(1,1-dimethylpropylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-[4-[(2-methylbutan-2-ylamino)-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-1-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]pyrazole-4-carboxylate Traditional Name: 1-[4-(tert-amylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C)C(=O)OCC)C

Isomeric SMILES

CCC(C)(C)NC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C)C(=O)OCC)C

InChI

InChI=1S/C20H27N3O3/c1-7-20(5,6)21-18(24)15-9-11-16(12-10-15)23-14(4)17(13(3)22-23)19(25)26-8-2/h9-12H,7-8H2,1-6H3,(H,21,24)