[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-(4-methoxyphenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-(4-methoxyphenyl)-1,3-thiazole-4-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-(4-methoxyphenyl)thiazole-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-4-thiazolecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-(4-methoxyphenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)thiazole-4-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C21H18FNO4S MolecularWeight: 399.435323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)C(=O)OCCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)C(=O)OCCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FNO4S/c1-26-17-10-6-15(7-11-17)20-23-18(13-28-20)21(25)27-12-2-3-19(24)14-4-8-16(22)9-5-14/h4-11,13H,2-3,12H2,1H3