N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-(phenylsulfonyl)propanamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)propanamide Traditional Name: 3-besyl-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)propionamide Formula: C22H24FN3O4S2 MolecularWeight: 477.572063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(C2=NC3=C(S2)C=C(C=C3)F)C(=O)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCN(C2=NC3=C(S2)C=C(C=C3)F)C(=O)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H24FN3O4S2/c23-17-6-7-19-20(16-17)31-22(24-19)26(10-9-25-11-13-30-14-12-25)21(27)8-15-32(28,29)18-4-2-1-3-5-18/h1-7,16H,8-15H2