methyl 3-[2-(5-chloranylthiophen-2-yl)carbonylimino-6-fluoranyl-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: methyl 3-[2-(5-chloranylthiophen-2-yl)carbonylimino-6-fluoranyl-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[2-(5-chlorothiophene-2-carbonyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-6-fluoro-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(5-chlorothiophene-2-carbonyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(5-chlorothiophene-2-carbonyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C16H12ClFN2O3S2 MolecularWeight: 398.859483

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC(=O)CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H12ClFN2O3S2/c1-23-14(21)6-7-20-10-3-2-9(18)8-12(10)25-16(20)19-15(22)11-4-5-13(17)24-11/h2-5,8H,6-7H2,1H3