N-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-4-ethyl-N-methyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-4-ethyl-N-methyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[1-(3,4-difluorophenyl)ethyl]-4-ethyl-N-methyl-3-morpholinosulfonyl-benzamide CAS Name: N-[1-(3,4-difluorophenyl)ethyl]-4-ethyl-N-methyl-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[1-(3,4-difluorophenyl)ethyl]-4-ethyl-N-methyl-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[1-(3,4-difluorophenyl)ethyl]-4-ethyl-N-methyl-3-morpholinosulfonyl-benzamide Formula: C22H26F2N2O4S MolecularWeight: 452.514646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)N(C)C(C)C2=CC(=C(C=C2)F)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)N(C)C(C)C2=CC(=C(C=C2)F)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H26F2N2O4S/c1-4-16-5-6-18(14-21(16)31(28,29)26-9-11-30-12-10-26)22(27)25(3)15(2)17-7-8-19(23)20(24)13-17/h5-8,13-15H,4,9-12H2,1-3H3