1-[2-propan-2-ylsulfonyl-5-(trifluoromethyl)phenyl]-1,4-diazepane

Systemtic Name: 1-[2-propan-2-ylsulfonyl-5-(trifluoromethyl)phenyl]-1,4-diazepane Openeye Name: 1-[2-isopropylsulfonyl-5-(trifluoromethyl)phenyl]-1,4-diazepane CAS Name: 1-[2-propan-2-ylsulfonyl-5-(trifluoromethyl)phenyl]-1,4-diazepane IUPAC Name: 1-[2-propan-2-ylsulfonyl-5-(trifluoromethyl)phenyl]-1,4-diazepane Traditional Name: 1-[2-isopropylsulfonyl-5-(trifluoromethyl)phenyl]-1,4-diazepane Formula: C15H21F3N2O2S MolecularWeight: 350.39965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)N2CCCNCC2

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)N2CCCNCC2

InChI

InChI=1S/C15H21F3N2O2S/c1-11(2)23(21,22)14-5-4-12(15(16,17)18)10-13(14)20-8-3-6-19-7-9-20/h4-5,10-11,19H,3,6-9H2,1-2H3