propyl 5-aminocarbonyl-2-[[1-[(3-chloranyl-4-fluoranyl-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: propyl 5-aminocarbonyl-2-[[1-[(3-chloranyl-4-fluoranyl-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: propyl 5-carbamoyl-2-[[1-[(3-chloro-4-fluoro-phenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[[1-[(3-chloro-4-fluorophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 5-carbamoyl-2-[[1-[(3-chloro-4-fluorophenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[1-[(3-chloro-4-fluoro-phenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylic acid propyl ester Formula: C21H20ClFN4O5S MolecularWeight: 494.923703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NN(C=C2)COC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NN(C=C2)COC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H20ClFN4O5S/c1-3-8-31-21(30)16-11(2)17(18(24)28)33-20(16)25-19(29)15-6-7-27(26-15)10-32-12-4-5-14(23)13(22)9-12/h4-7,9H,3,8,10H2,1-2H3,(H2,24,28)(H,25,29)