[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-benzamidobutanoate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-benzamidobutanoate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C21H19FN2O3S MolecularWeight: 398.450563

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC1=CSC(=N1)C2=CC=C(C=C2)F)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)OCC1=CSC(=N1)C2=CC=C(C=C2)F)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19FN2O3S/c1-14(23-20(26)15-5-3-2-4-6-15)11-19(25)27-12-18-13-28-21(24-18)16-7-9-17(22)10-8-16/h2-10,13-14H,11-12H2,1H3,(H,23,26)