N-(1,3-benzothiazol-2-yl)-N-ethyl-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C20H20FN3O4S2 MolecularWeight: 449.518903

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

InChI

InChI=1S/C20H20FN3O4S2/c1-2-24(20-22-17-5-3-4-6-18(17)29-20)19(25)15-13-14(7-8-16(15)21)30(26,27)23-9-11-28-12-10-23/h3-8,13H,2,9-12H2,1H3