1-(phenylmethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-1,4-diazepane

Systemtic Name: 1-(phenylmethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-1,4-diazepane Openeye Name: 1-benzyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-1,4-diazepane CAS Name: 1-(phenylmethyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-1,4-diazepane IUPAC Name: 1-benzyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-1,4-diazepane Traditional Name: 1-benzyl-4-[3-(trifluoromethyl)phenyl]sulfonyl-1,4-diazepane Formula: C19H21F3N2O2S MolecularWeight: 398.44245

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C19H21F3N2O2S/c20-19(21,22)17-8-4-9-18(14-17)27(25,26)24-11-5-10-23(12-13-24)15-16-6-2-1-3-7-16/h1-4,6-9,14H,5,10-13,15H2