[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(4-fluorophenyl)-4-methyl-5-thiazolecarboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C19H21FN2O3S MolecularWeight: 376.445043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)OCC(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)OCC(=O)N3CCCCCC3

InChI

InChI=1S/C19H21FN2O3S/c1-13-17(26-18(21-13)14-6-8-15(20)9-7-14)19(24)25-12-16(23)22-10-4-2-3-5-11-22/h6-9H,2-5,10-12H2,1H3