[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 4-methyl-2-phenyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-phenyl-5-thiazolecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-phenyl-thiazole-5-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C21H18FNO3S MolecularWeight: 383.435923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)OCCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)OCCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FNO3S/c1-14-19(27-20(23-14)16-6-3-2-4-7-16)21(25)26-13-5-8-18(24)15-9-11-17(22)12-10-15/h2-4,6-7,9-12H,5,8,13H2,1H3