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

Systemtic Name: O2-methyl O4-propyl 5-[[3-(4-fluorophenyl)-1H-pyrazol-5-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-methyl 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-methyl ester O4-propyl ester IUPAC Name: 2-O-methyl 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-methyl ester O4-propyl ester Formula: C21H20FN3O5S MolecularWeight: 445.464003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20FN3O5S/c1-4-9-30-20(27)16-11(2)17(21(28)29-3)31-19(16)23-18(26)15-10-14(24-25-15)12-5-7-13(22)8-6-12/h5-8,10H,4,9H2,1-3H3,(H,23,26)(H,24,25)