1-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-3-[4-(2-methylsulfinylpyrimidin-4-yl)oxynaphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-3-[4-(2-methylsulfinylpyrimidin-4-yl)oxynaphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-3-[4-(2-methylsulfinylpyrimidin-4-yl)oxy-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-3-[4-[(2-methylsulfinyl-4-pyrimidinyl)oxy]-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-3-[4-(2-methylsulfinylpyrimidin-4-yl)oxynaphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-3-[4-(2-methylsulfinylpyrimidin-4-yl)oxy-1-naphthyl]urea Formula: C28H31N5O6S2 MolecularWeight: 597.70564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OC4=NC(=NC=C4)S(=O)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OC4=NC(=NC=C4)S(=O)C

InChI

InChI=1S/C28H31N5O6S2/c1-28(2,3)17-15-21(25(38-4)22(16-17)33-41(6,36)37)31-26(34)30-20-11-12-23(19-10-8-7-9-18(19)20)39-24-13-14-29-27(32-24)40(5)35/h7-16,33H,1-6H3,(H2,30,31,34)