5-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide

Systemtic Name: 5-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide Openeye Name: 5-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide CAS Name: 5-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-phthalazinyl]-N,N,2-trimethylbenzenesulfonamide IUPAC Name: 5-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphthalazin-1-yl]-N,N,2-trimethylbenzenesulfonamide Traditional Name: 5-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide Formula: C23H23N5O2S2 MolecularWeight: 465.59102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=NC(=CC(=N4)C)C)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=NC(=CC(=N4)C)C)S(=O)(=O)N(C)C

InChI

InChI=1S/C23H23N5O2S2/c1-14-10-11-17(13-20(14)32(29,30)28(4)5)21-18-8-6-7-9-19(18)22(27-26-21)31-23-24-15(2)12-16(3)25-23/h6-13H,1-5H3