2-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide Openeye Name: 2-(3,4-difluorophenyl)sulfanyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)propanamide CAS Name: 2-[(3,4-difluorophenyl)thio]-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(3,4-difluorophenyl)sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-[(3,4-difluorophenyl)thio]-N-(4-methyl-3-morpholinosulfonyl-phenyl)propionamide Formula: C20H22F2N2O4S2 MolecularWeight: 456.526486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC(=C(C=C2)F)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC(=C(C=C2)F)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H22F2N2O4S2/c1-13-3-4-15(11-19(13)30(26,27)24-7-9-28-10-8-24)23-20(25)14(2)29-16-5-6-17(21)18(22)12-16/h3-6,11-12,14H,7-10H2,1-2H3,(H,23,25)