ethyl 5-(4-ethylphenyl)-1-[4-(2-methylpropylcarbamoyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(4-ethylphenyl)-1-[4-(2-methylpropylcarbamoyl)phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-(4-ethylphenyl)-1-[4-(isobutylcarbamoyl)phenyl]pyrazole-3-carboxylate CAS Name: 5-(4-ethylphenyl)-1-[4-[(2-methylpropylamino)-oxomethyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-ethylphenyl)-1-[4-(2-methylpropylcarbamoyl)phenyl]pyrazole-3-carboxylate Traditional Name: 5-(4-ethylphenyl)-1-[4-(isobutylcarbamoyl)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C(=O)NCC(C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C(=O)NCC(C)C)C(=O)OCC

InChI

InChI=1S/C25H29N3O3/c1-5-18-7-9-19(10-8-18)23-15-22(25(30)31-6-2)27-28(23)21-13-11-20(12-14-21)24(29)26-16-17(3)4/h7-15,17H,5-6,16H2,1-4H3,(H,26,29)