methyl 2-[[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[[5-(3-chloro-4-fluoro-phenyl)furan-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[5-(3-chloro-4-fluorophenyl)-2-furanyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[5-(3-chloro-4-fluorophenyl)furan-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[5-(3-chloro-4-fluoro-phenyl)-2-furoyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H12ClFN2O4S MolecularWeight: 430.836683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H12ClFN2O4S/c1-27-19(26)11-3-5-14-17(9-11)29-20(23-14)24-18(25)16-7-6-15(28-16)10-2-4-13(22)12(21)8-10/h2-9H,1H3,(H,23,24,25)