2-[4-[3,5-bis(fluoranyl)phenyl]sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[3,5-bis(fluoranyl)phenyl]sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(3,5-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-(3,5-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(3,5-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(3,5-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidino-ethanone Formula: C17H23F2N3O3S MolecularWeight: 387.444626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCCN(CC2)S(=O)(=O)C3=CC(=CC(=C3)F)F

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCCN(CC2)S(=O)(=O)C3=CC(=CC(=C3)F)F

InChI

InChI=1S/C17H23F2N3O3S/c18-14-10-15(19)12-16(11-14)26(24,25)22-7-3-4-20(8-9-22)13-17(23)21-5-1-2-6-21/h10-12H,1-9,13H2