methyl 5-azanyl-1-[4-(4-phenylbutan-2-ylcarbamoyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[4-(4-phenylbutan-2-ylcarbamoyl)phenyl]pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-[4-[(1-methyl-3-phenyl-propyl)carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[oxo-(4-phenylbutan-2-ylamino)methyl]phenyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[4-(4-phenylbutan-2-ylcarbamoyl)phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(1-methyl-3-phenyl-propyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid methyl ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OC)N

InChI

InChI=1S/C22H24N4O3/c1-15(8-9-16-6-4-3-5-7-16)25-21(27)17-10-12-18(13-11-17)26-20(23)19(14-24-26)22(28)29-2/h3-7,10-15H,8-9,23H2,1-2H3,(H,25,27)