ethyl 5-azanyl-1-[4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[3-(2-oxopyrrolidin-1-yl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[oxo-[3-(2-oxo-1-pyrrolidinyl)propylamino]methyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[3-(2-oxopyrrolidin-1-yl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[3-(2-ketopyrrolidino)propylcarbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCCN3CCCC3=O)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCCN3CCCC3=O)N

InChI

InChI=1S/C20H25N5O4/c1-2-29-20(28)16-13-23-25(18(16)21)15-8-6-14(7-9-15)19(27)22-10-4-12-24-11-3-5-17(24)26/h6-9,13H,2-5,10-12,21H2,1H3,(H,22,27)