[2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 2-fluoranylbenzoate

Systemtic Name: [2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 2-fluoranylbenzoate Openeye Name: [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [2-(N-acetyl-2,6-dimethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2,6-dimethylanilino)-1,3-thiazol-4-yl]methyl 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl ester Formula: C21H19FN2O3S MolecularWeight: 398.450563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)COC(=O)C3=CC=CC=C3F)C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)COC(=O)C3=CC=CC=C3F)C(=O)C

InChI

InChI=1S/C21H19FN2O3S/c1-13-7-6-8-14(2)19(13)24(15(3)25)21-23-16(12-28-21)11-27-20(26)17-9-4-5-10-18(17)22/h4-10,12H,11H2,1-3H3