O2-ethyl O4-propyl 5-[[3-(4-fluorophenyl)-1H-pyrazol-5-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-propyl 5-[[3-(4-fluorophenyl)-1H-pyrazol-5-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-propyl 5-[[3-(4-fluorophenyl)-1H-pyrazole-5-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propyl ester IUPAC Name: 2-O-ethyl 4-O-propyl 5-[[3-(4-fluorophenyl)-1H-pyrazole-5-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[3-(4-fluorophenyl)-1H-pyrazole-5-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propyl ester Formula: C22H22FN3O5S MolecularWeight: 459.490583

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FN3O5S/c1-4-10-31-21(28)17-12(3)18(22(29)30-5-2)32-20(17)24-19(27)16-11-15(25-26-16)13-6-8-14(23)9-7-13/h6-9,11H,4-5,10H2,1-3H3,(H,24,27)(H,25,26)