ethyl 5-ethyl-2-[2-[4-(pyrazol-1-ylmethyl)phenyl]carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[4-(pyrazol-1-ylmethyl)phenyl]carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[4-(pyrazol-1-ylmethyl)benzoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[oxo-[4-(1-pyrazolylmethyl)phenyl]methoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[4-(pyrazol-1-ylmethyl)benzoyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[4-(pyrazol-1-ylmethyl)benzoyl]oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)C2=CC=C(C=C2)CN3C=CC=N3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)C2=CC=C(C=C2)CN3C=CC=N3)C(=O)OCC

InChI

InChI=1S/C22H23N3O5S/c1-3-17-12-18(22(28)29-4-2)20(31-17)24-19(26)14-30-21(27)16-8-6-15(7-9-16)13-25-11-5-10-23-25/h5-12H,3-4,13-14H2,1-2H3,(H,24,26)