N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-fluoranyl-benzamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-fluoro-benzamide CAS Name: 3-fluoro-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-fluorobenzamide Traditional Name: N-(2-butyramido-1,3-benzothiazol-6-yl)-3-fluoro-benzamide Formula: C18H16FN3O2S MolecularWeight: 357.401943

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H16FN3O2S/c1-2-4-16(23)22-18-21-14-8-7-13(10-15(14)25-18)20-17(24)11-5-3-6-12(19)9-11/h3,5-10H,2,4H2,1H3,(H,20,24)(H,21,22,23)