1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-[2,4,5-tris(chloranyl)phenyl]sulfonyl-1,4-diazepane

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-[2,4,5-tris(chloranyl)phenyl]sulfonyl-1,4-diazepane Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepane CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepane Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepane Formula: C17H14Cl4F3N3O2S MolecularWeight: 523.18417

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C17H14Cl4F3N3O2S/c18-11-7-13(20)15(8-12(11)19)30(28,29)27-3-1-2-26(4-5-27)16-14(21)6-10(9-25-16)17(22,23)24/h6-9H,1-5H2