ethyl 5-[[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]methyl]-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]methyl]-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[[3-(2-oxopyrrolidin-1-yl)propylamino]methyl]-1-(4-phenylthiazol-2-yl)pyrazole-4-carboxylate CAS Name: 5-[[3-(2-oxo-1-pyrrolidinyl)propylamino]methyl]-1-(4-phenyl-2-thiazolyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[3-(2-oxopyrrolidin-1-yl)propylamino]methyl]-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate Traditional Name: 5-[[3-(2-ketopyrrolidino)propylamino]methyl]-1-(4-phenylthiazol-2-yl)pyrazole-4-carboxylic acid ethyl ester Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CNCCCN4CCCC4=O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CNCCCN4CCCC4=O

InChI

InChI=1S/C23H27N5O3S/c1-2-31-22(30)18-14-25-28(23-26-19(16-32-23)17-8-4-3-5-9-17)20(18)15-24-11-7-13-27-12-6-10-21(27)29/h3-5,8-9,14,16,24H,2,6-7,10-13,15H2,1H3