ethyl 1-[4-(4-phenylbutan-2-ylcarbamoyl)phenyl]-5-propan-2-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[4-(4-phenylbutan-2-ylcarbamoyl)phenyl]-5-propan-2-yl-pyrazole-3-carboxylate Openeye Name: ethyl 5-isopropyl-1-[4-[(1-methyl-3-phenyl-propyl)carbamoyl]phenyl]pyrazole-3-carboxylate CAS Name: 1-[4-[oxo-(4-phenylbutan-2-ylamino)methyl]phenyl]-5-propan-2-yl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(4-phenylbutan-2-ylcarbamoyl)phenyl]-5-propan-2-ylpyrazole-3-carboxylate Traditional Name: 5-isopropyl-1-[4-[(1-methyl-3-phenyl-propyl)carbamoyl]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C(C)C)C2=CC=C(C=C2)C(=O)NC(C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C(C)C)C2=CC=C(C=C2)C(=O)NC(C)CCC3=CC=CC=C3

InChI

InChI=1S/C26H31N3O3/c1-5-32-26(31)23-17-24(18(2)3)29(28-23)22-15-13-21(14-16-22)25(30)27-19(4)11-12-20-9-7-6-8-10-20/h6-10,13-19H,5,11-12H2,1-4H3,(H,27,30)