1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-oxo-pyridine-3-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-oxo-3-pyridinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-oxopyridine-3-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-keto-nicotinamide Formula: C22H17ClFN3O3S MolecularWeight: 457.905083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CN(C3=O)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CN(C3=O)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H17ClFN3O3S/c1-2-30-13-8-9-18-19(11-13)31-22(25-18)26-20(28)14-5-4-10-27(21(14)29)12-15-16(23)6-3-7-17(15)24/h3-11H,2,12H2,1H3,(H,25,26,28)