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

Systemtic Name: 2-[(2S)-1-[(3-chloranyl-4-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[(1S)-2-(3-chloro-4-methoxy-anilino)-1-methyl-2-oxo-ethyl]thiazole-4-carboxylate CAS Name: 2-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-thiazolecarboxylate IUPAC Name: 2-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(1S)-2-(3-chloro-4-methoxy-anilino)-2-keto-1-methyl-ethyl]thiazole-4-carboxylate Formula: C14H12ClN2O4S- MolecularWeight: 339.77408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=CS1)C(=O)[O-])C(=O)NC2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

C[C@H](C1=NC(=CS1)C(=O)[O-])C(=O)NC2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C14H13ClN2O4S/c1-7(13-17-10(6-22-13)14(19)20)12(18)16-8-3-4-11(21-2)9(15)5-8/h3-7H,1-2H3,(H,16,18)(H,19,20)/p-1/t7-/m0/s1