methyl 3-[2-(4-chlorophenyl)carbonylimino-6-fluoranyl-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: methyl 3-[2-(4-chlorophenyl)carbonylimino-6-fluoranyl-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[2-(4-chlorobenzoyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[(4-chlorophenyl)-oxomethyl]imino-6-fluoro-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(4-chlorobenzoyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(4-chlorobenzoyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C18H14ClFN2O3S MolecularWeight: 392.831763

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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(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClFN2O3S/c1-25-16(23)8-9-22-14-7-6-13(20)10-15(14)26-18(22)21-17(24)11-2-4-12(19)5-3-11/h2-7,10H,8-9H2,1H3