methyl 3-[2-(furan-2-ylcarbonylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: methyl 3-[2-(furan-2-ylcarbonylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[2-(furan-2-carbonylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[2-furanyl(oxo)methyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(furan-2-carbonylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(2-furoylimino)-6-mesyl-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C17H16N2O6S2 MolecularWeight: 408.44874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)CCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=CO3

InChI

InChI=1S/C17H16N2O6S2/c1-24-15(20)7-8-19-12-6-5-11(27(2,22)23)10-14(12)26-17(19)18-16(21)13-4-3-9-25-13/h3-6,9-10H,7-8H2,1-2H3