3-fluoranyl-4-(hexadecylamino)-N-methylsulfonyl-benzamide

Systemtic Name: 3-fluoranyl-4-(hexadecylamino)-N-methylsulfonyl-benzamide Openeye Name: 3-fluoro-4-(hexadecylamino)-N-methylsulfonyl-benzamide CAS Name: 3-fluoro-4-(hexadecylamino)-N-methylsulfonylbenzamide IUPAC Name: 3-fluoro-4-(hexadecylamino)-N-methylsulfonylbenzamide Traditional Name: 4-(cetylamino)-3-fluoro-N-mesyl-benzamide Formula: C24H41FN2O3S MolecularWeight: 456.657343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C(C=C(C=C1)C(=O)NS(=O)(=O)C)F

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C(C=C(C=C1)C(=O)NS(=O)(=O)C)F

InChI

InChI=1S/C24H41FN2O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-26-23-18-17-21(20-22(23)25)24(28)27-31(2,29)30/h17-18,20,26H,3-16,19H2,1-2H3,(H,27,28)