ethyl 4-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[1-(3-fluoro-4-phenyl-phenyl)ethyl]-2-(methylamino)thiazole-5-carboxylate CAS Name: 4-[1-(3-fluoro-4-phenylphenyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(3-fluoro-4-phenylphenyl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate Traditional Name: 4-[1-(3-fluoro-4-phenyl-phenyl)ethyl]-2-(methylamino)thiazole-5-carboxylic acid ethyl ester Formula: C21H21FN2O2S MolecularWeight: 384.467043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC)C(C)C2=CC(=C(C=C2)C3=CC=CC=C3)F

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC)C(C)C2=CC(=C(C=C2)C3=CC=CC=C3)F

InChI

InChI=1S/C21H21FN2O2S/c1-4-26-20(25)19-18(24-21(23-3)27-19)13(2)15-10-11-16(17(22)12-15)14-8-6-5-7-9-14/h5-13H,4H2,1-3H3,(H,23,24)