[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate CAS Name: 4-cyano-2-methyl-5-(1-pyrrolyl)-3-furancarboxylic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carboxylate Traditional Name: 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylic acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C21H14FN3O3S MolecularWeight: 407.417563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H14FN3O3S/c1-13-18(17(10-23)20(28-13)25-8-2-3-9-25)21(26)27-11-16-12-29-19(24-16)14-4-6-15(22)7-5-14/h2-9,12H,11H2,1H3