ethyl 4-[2-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]carbonyloxyethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]carbonyloxyethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[1-benzyl-3-(2-thienyl)pyrazole-4-carbonyl]oxyacetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-2-[oxo-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methoxy]ethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1-benzyl-3-thiophen-2-ylpyrazole-4-carbonyl)oxyacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[1-benzyl-3-(2-thienyl)pyrazole-4-carbonyl]oxyacetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H28N4O5S MolecularWeight: 496.57862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O5S/c1-2-33-25(32)28-12-10-19(11-13-28)26-22(30)17-34-24(31)20-16-29(15-18-7-4-3-5-8-18)27-23(20)21-9-6-14-35-21/h3-9,14,16,19H,2,10-13,15,17H2,1H3,(H,26,30)