2-[(2S)-1-[(5-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[(2S)-1-[(5-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[(1S)-2-(5-chloro-2-methyl-anilino)-1-methyl-2-oxo-ethyl]thiazole-4-carboxylate CAS Name: 2-[(2S)-1-(5-chloro-2-methylanilino)-1-oxopropan-2-yl]-4-thiazolecarboxylate IUPAC Name: 2-[(2S)-1-(5-chloro-2-methylanilino)-1-oxopropan-2-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(1S)-2-(5-chloro-2-methyl-anilino)-2-keto-1-methyl-ethyl]thiazole-4-carboxylate Formula: C14H12ClN2O3S- MolecularWeight: 323.77468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN2O3S/c1-7-3-4-9(15)5-10(7)16-12(18)8(2)13-17-11(6-21-13)14(19)20/h3-6,8H,1-2H3,(H,16,18)(H,19,20)/p-1/t8-/m0/s1