4-fluoranyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-morpholinosulfonyl-benzamide CAS Name: 4-fluoro-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3-morpholinosulfonyl-benzamide Formula: C19H18FN3O4S3 MolecularWeight: 467.557323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C19H18FN3O4S3/c1-28-19-22-15-5-3-13(11-16(15)29-19)21-18(24)12-2-4-14(20)17(10-12)30(25,26)23-6-8-27-9-7-23/h2-5,10-11H,6-9H2,1H3,(H,21,24)