6-[2-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-4-yl]-N-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]quinazolin-4-amine

Systemtic Name: 6-[2-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-4-yl]-N-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]quinazolin-4-amine Openeye Name: N-[4-benzyloxy-3-(trifluoromethyl)phenyl]-6-[2-[(2-methylsulfonylethylamino)methyl]thiazol-4-yl]quinazolin-4-amine CAS Name: 6-[2-[(2-methylsulfonylethylamino)methyl]-4-thiazolyl]-N-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]-4-quinazolinamine IUPAC Name: 6-[2-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-4-yl]-N-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]quinazolin-4-amine Traditional Name: [4-[4-[4-benzoxy-3-(trifluoromethyl)anilino]quinazolin-6-yl]thiazol-2-yl]methyl-(2-mesylethyl)amine Formula: C29H26F3N5O3S2 MolecularWeight: 613.67365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNCC1=NC(=CS1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)CCNCC1=NC(=CS1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C29H26F3N5O3S2/c1-42(38,39)12-11-33-15-27-37-25(17-41-27)20-7-9-24-22(13-20)28(35-18-34-24)36-21-8-10-26(23(14-21)29(30,31)32)40-16-19-5-3-2-4-6-19/h2-10,13-14,17-18,33H,11-12,15-16H2,1H3,(H,34,35,36)