(2S)-2-[[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[2-(2-fluorophenyl)-4-methyl-thiazole-5-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[2-(2-fluorophenyl)-4-methyl-5-thiazolyl]-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[2-(2-fluorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(2-fluorophenyl)-4-methyl-thiazole-5-carbonyl]amino]-3-phenyl-propionate Formula: C20H16FN2O3S- MolecularWeight: 383.416043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2F)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2F)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H17FN2O3S/c1-12-17(27-19(22-12)14-9-5-6-10-15(14)21)18(24)23-16(20(25)26)11-13-7-3-2-4-8-13/h2-10,16H,11H2,1H3,(H,23,24)(H,25,26)/p-1/t16-/m0/s1