ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-(4-pyrazol-1-ylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-(4-pyrazol-1-ylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-(4-pyrazol-1-ylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[1-oxo-2-[oxo-[4-(1-pyrazolyl)phenyl]methoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-(4-pyrazol-1-ylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-methyl-5-(methylcarbamoyl)-2-[[2-(4-pyrazol-1-ylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H22N4O6S MolecularWeight: 470.49828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C22H22N4O6S/c1-4-31-22(30)17-13(2)18(19(28)23-3)33-20(17)25-16(27)12-32-21(29)14-6-8-15(9-7-14)26-11-5-10-24-26/h5-11H,4,12H2,1-3H3,(H,23,28)(H,25,27)