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

Systemtic Name: methyl 3-[6-bromanyl-2-(furan-2-ylcarbonylimino)-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[6-bromo-2-(furan-2-carbonylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[6-bromo-2-[2-furanyl(oxo)methyl]imino-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[6-bromo-2-(furan-2-carbonylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[6-bromo-2-(2-furoylimino)-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C16H13BrN2O4S MolecularWeight: 409.25442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrN2O4S/c1-22-14(20)6-7-19-11-5-4-10(17)9-13(11)24-16(19)18-15(21)12-3-2-8-23-12/h2-5,8-9H,6-7H2,1H3