(2S)-2-[[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]carbonylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-(4-chlorophenyl)-4-methyl-thiazole-5-carbonyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[[2-(4-chlorophenyl)-4-methyl-5-thiazolyl]-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-(4-chlorophenyl)-4-methyl-thiazole-5-carbonyl]amino]-3-methyl-butyrate Formula: C16H16ClN2O3S- MolecularWeight: 351.82784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)Cl)C(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN2O3S/c1-8(2)12(16(21)22)19-14(20)13-9(3)18-15(23-13)10-4-6-11(17)7-5-10/h4-8,12H,1-3H3,(H,19,20)(H,21,22)/p-1/t12-/m0/s1