1-[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]-1,4-diazepan-5-one

Systemtic Name: 1-[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]-1,4-diazepan-5-one Openeye Name: 1-[1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]-1,4-diazepan-5-one CAS Name: 1-[1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]-1,4-diazepan-5-one IUPAC Name: 1-[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]-1,4-diazepan-5-one Traditional Name: 1-[1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]-1,4-diazepan-5-one Formula: C17H22F3N3O3S MolecularWeight: 405.43509

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCC(=O)NCC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CCC1N2CCC(=O)NCC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C17H22F3N3O3S/c18-17(19,20)14-3-1-2-4-15(14)27(25,26)23-10-5-13(6-11-23)22-9-7-16(24)21-8-12-22/h1-4,13H,5-12H2,(H,21,24)