ethyl 4-(4-ethoxyphenyl)-2-[(1-ethylpyrazol-3-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-ethoxyphenyl)-2-[(1-ethylpyrazol-3-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(4-ethoxyphenyl)-2-[(1-ethylpyrazole-3-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-[[(1-ethyl-3-pyrazolyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxyphenyl)-2-[(1-ethylpyrazole-3-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(1-ethylpyrazole-3-carbonyl)amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)OCC)C(=O)OCC

Isomeric SMILES

CCN1C=CC(=N1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)OCC)C(=O)OCC

InChI

InChI=1S/C22H25N3O4S/c1-5-25-13-12-17(24-25)20(26)23-21-19(22(27)29-7-3)18(14(4)30-21)15-8-10-16(11-9-15)28-6-2/h8-13H,5-7H2,1-4H3,(H,23,26)