1-thiophen-2-ylsulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane

Systemtic Name: 1-thiophen-2-ylsulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-(2-thienylsulfonyl)-4-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-thiophen-2-ylsulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-thiophen-2-ylsulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-(2-thienylsulfonyl)-4-[4-(trifluoromethyl)benzyl]-1,4-diazepane Formula: C17H19F3N2O2S2 MolecularWeight: 404.47017

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=CS2)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=CS2)CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H19F3N2O2S2/c18-17(19,20)15-6-4-14(5-7-15)13-21-8-2-9-22(11-10-21)26(23,24)16-3-1-12-25-16/h1,3-7,12H,2,8-11,13H2