2-fluoranyl-4-(hexadecylamino)-N-(4-methylphenyl)sulfonyl-benzamide

Systemtic Name: 2-fluoranyl-4-(hexadecylamino)-N-(4-methylphenyl)sulfonyl-benzamide Openeye Name: 2-fluoro-4-(hexadecylamino)-N-(p-tolylsulfonyl)benzamide CAS Name: 2-fluoro-4-(hexadecylamino)-N-(4-methylphenyl)sulfonylbenzamide IUPAC Name: 2-fluoro-4-(hexadecylamino)-N-(4-methylphenyl)sulfonylbenzamide Traditional Name: 4-(cetylamino)-2-fluoro-N-tosyl-benzamide Formula: C30H45FN2O3S MolecularWeight: 532.753303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)F

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)F

InChI

InChI=1S/C30H45FN2O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-32-26-19-22-28(29(31)24-26)30(34)33-37(35,36)27-20-17-25(2)18-21-27/h17-22,24,32H,3-16,23H2,1-2H3,(H,33,34)