ethyl 2-[(3-chloranyl-4-fluoranyl-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[(3-chloranyl-4-fluoranyl-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[(3-chloro-4-fluoro-benzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(3-chloro-4-fluorophenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-chloro-4-fluorobenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-chloro-4-fluoro-benzoyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C17H12ClFN2O3S MolecularWeight: 378.805183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H12ClFN2O3S/c1-2-24-16(23)10-4-6-13-14(8-10)25-17(20-13)21-15(22)9-3-5-12(19)11(18)7-9/h3-8H,2H2,1H3,(H,20,21,22)