(3-pyrrol-1-ylthiophen-2-yl)methyl 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: (3-pyrrol-1-ylthiophen-2-yl)methyl 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: (3-pyrrol-1-yl-2-thienyl)methyl 3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylate CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid [3-(1-pyrrolyl)-2-thiophenyl]methyl ester IUPAC Name: (3-pyrrol-1-ylthiophen-2-yl)methyl 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylic acid (3-pyrrol-1-yl-2-thienyl)methyl ester Formula: C20H14ClFN2O3S MolecularWeight: 416.853163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)OCC3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)OCC3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C20H14ClFN2O3S/c1-12-17(19(23-27-12)18-13(21)5-4-6-14(18)22)20(25)26-11-16-15(7-10-28-16)24-8-2-3-9-24/h2-10H,11H2,1H3