4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-(6-fluoranyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-(6-fluoranyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-(6-fluoro-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-(6-fluoro-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-(6-fluoro-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-(6-fluoro-1,3-benzothiazol-2-yl)butyramide Formula: C20H20FN3O4S2 MolecularWeight: 449.518903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)F

InChI

InChI=1S/C20H20FN3O4S2/c1-13(25)14-5-8-16(9-6-14)30(27,28)24(2)11-3-4-19(26)23-20-22-17-10-7-15(21)12-18(17)29-20/h5-10,12H,3-4,11H2,1-2H3,(H,22,23,26)