2-[(2S)-1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[(2S)-1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[(1S)-1-methyl-2-oxo-2-(2,4,6-trimethylanilino)ethyl]thiazole-4-carboxylate CAS Name: 2-[(2S)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]-4-thiazolecarboxylate IUPAC Name: 2-[(2S)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(1S)-2-keto-2-mesidino-1-methyl-ethyl]thiazole-4-carboxylate Formula: C16H17N2O3S- MolecularWeight: 317.38278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)C2=NC(=CS2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)[C@H](C)C2=NC(=CS2)C(=O)[O-])C

InChI

InChI=1S/C16H18N2O3S/c1-8-5-9(2)13(10(3)6-8)18-14(19)11(4)15-17-12(7-22-15)16(20)21/h5-7,11H,1-4H3,(H,18,19)(H,20,21)/p-1/t11-/m0/s1