methyl 2-[6-methylsulfonyl-2-(1,2-oxazol-5-ylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-methylsulfonyl-2-(1,2-oxazol-5-ylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(isoxazole-5-carbonylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[5-isoxazolyl(oxo)methyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-methylsulfonyl-2-(1,2-oxazole-5-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(isoxazole-5-carbonylimino)-6-mesyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C15H13N3O6S2 MolecularWeight: 395.41022

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=NO3

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=NO3

InChI

InChI=1S/C15H13N3O6S2/c1-23-13(19)8-18-10-4-3-9(26(2,21)22)7-12(10)25-15(18)17-14(20)11-5-6-16-24-11/h3-7H,8H2,1-2H3