ethyl 5-ethanoyl-4-methyl-2-[[1-(pyrazol-1-ylmethyl)pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[[1-(pyrazol-1-ylmethyl)pyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[oxo-[1-(1-pyrazolylmethyl)-3-pyrazolyl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=C2)CN3C=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NN(C=C2)CN3C=CC=N3

InChI

InChI=1S/C18H19N5O4S/c1-4-27-18(26)14-11(2)15(12(3)24)28-17(14)20-16(25)13-6-9-23(21-13)10-22-8-5-7-19-22/h5-9H,4,10H2,1-3H3,(H,20,25)