N-[2-[2,2-bis(bromanyl)ethoxy]-4-nitro-phenyl]-N-(pyrimidin-5-ylmethyl)methanesulfonamide

Systemtic Name: N-[2-[2,2-bis(bromanyl)ethoxy]-4-nitro-phenyl]-N-(pyrimidin-5-ylmethyl)methanesulfonamide Openeye Name: N-[2-(2,2-dibromoethoxy)-4-nitro-phenyl]-N-(pyrimidin-5-ylmethyl)methanesulfonamide CAS Name: N-[2-(2,2-dibromoethoxy)-4-nitrophenyl]-N-(5-pyrimidinylmethyl)methanesulfonamide IUPAC Name: N-[2-(2,2-dibromoethoxy)-4-nitrophenyl]-N-(pyrimidin-5-ylmethyl)methanesulfonamide Traditional Name: N-[2-(2,2-dibromoethoxy)-4-nitro-phenyl]-N-(5-pyrimidylmethyl)methanesulfonamide Formula: C14H14Br2N4O5S MolecularWeight: 510.15776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CN=CN=C1)C2=C(C=C(C=C2)[N+](=O)[O-])OCC(Br)Br

Isomeric SMILES

CS(=O)(=O)N(CC1=CN=CN=C1)C2=C(C=C(C=C2)[N+](=O)[O-])OCC(Br)Br

InChI

InChI=1S/C14H14Br2N4O5S/c1-26(23,24)19(7-10-5-17-9-18-6-10)12-3-2-11(20(21)22)4-13(12)25-8-14(15)16/h2-6,9,14H,7-8H2,1H3