(2-acetamido-1,3-thiazol-4-yl)methyl 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C14H13ClN2O5S2 MolecularWeight: 388.84642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C14H13ClN2O5S2/c1-8(18)16-14-17-9(7-23-14)6-22-13(19)11-5-10(24(2,20)21)3-4-12(11)15/h3-5,7H,6H2,1-2H3,(H,16,17,18)