(5-chloranyl-2-methoxy-phenyl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: (5-chloro-2-methoxy-phenyl)methyl 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid (5-chloro-2-methoxyphenyl)methyl ester IUPAC Name: (5-chloro-2-methoxyphenyl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid (5-chloro-2-methoxy-benzyl) ester Formula: C14H15ClN2O3S MolecularWeight: 326.7985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC2=C(C=CC(=C2)Cl)OC)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC2=C(C=CC(=C2)Cl)OC)NC

InChI

InChI=1S/C14H15ClN2O3S/c1-8-12(13(16-2)21-17-8)14(18)20-7-9-6-10(15)4-5-11(9)19-3/h4-6,16H,7H2,1-3H3