ethyl 4,5-dimethyl-2-[[1-(phenoxymethyl)pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[[1-(phenoxymethyl)pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[1-(phenoxymethyl)pyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[oxo-[1-(phenoxymethyl)-3-pyrazolyl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[1-(phenoxymethyl)pyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[1-(phenoxymethyl)pyrazole-3-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S/c1-4-26-20(25)17-13(2)14(3)28-19(17)21-18(24)16-10-11-23(22-16)12-27-15-8-6-5-7-9-15/h5-11H,4,12H2,1-3H3,(H,21,24)