N-[6-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-bromanyl-2-methoxy-phenyl]naphthalen-2-yl]methanesulfonamide

Systemtic Name: N-[6-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-bromanyl-2-methoxy-phenyl]naphthalen-2-yl]methanesulfonamide Openeye Name: N-[6-[3-bromo-5-(2,4-dioxopyrimidin-1-yl)-2-methoxy-phenyl]-2-naphthyl]methanesulfonamide CAS Name: N-[6-[3-bromo-5-(2,4-dioxo-1-pyrimidinyl)-2-methoxyphenyl]-2-naphthalenyl]methanesulfonamide IUPAC Name: N-[6-[3-bromo-5-(2,4-dioxopyrimidin-1-yl)-2-methoxyphenyl]naphthalen-2-yl]methanesulfonamide Traditional Name: N-[6-[3-bromo-5-(2,4-diketopyrimidin-1-yl)-2-methoxy-phenyl]-2-naphthyl]methanesulfonamide Formula: C22H18BrN3O5S MolecularWeight: 516.36442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C2=CC3=C(C=C2)C=C(C=C3)NS(=O)(=O)C)N4C=CC(=O)NC4=O)Br

Isomeric SMILES

COC1=C(C=C(C=C1C2=CC3=C(C=C2)C=C(C=C3)NS(=O)(=O)C)N4C=CC(=O)NC4=O)Br

InChI

InChI=1S/C22H18BrN3O5S/c1-31-21-18(11-17(12-19(21)23)26-8-7-20(27)24-22(26)28)15-4-3-14-10-16(25-32(2,29)30)6-5-13(14)9-15/h3-12,25H,1-2H3,(H,24,27,28)