ethyl 5-methyl-1-[4-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methylcarbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methylcarbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylcarbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[oxo-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methylamino]methyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylcarbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 1-[4-[[4-(2-ketopyrrolidino)benzyl]carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O)C

InChI

InChI=1S/C25H26N4O4/c1-3-33-25(32)22-16-27-29(17(22)2)21-12-8-19(9-13-21)24(31)26-15-18-6-10-20(11-7-18)28-14-4-5-23(28)30/h6-13,16H,3-5,14-15H2,1-2H3,(H,26,31)