N-[[4-(5-bromanylpyrimidin-2-yl)oxy-3-(methylsulfanylmethyl)phenyl]carbamoyl]-2-(dimethylamino)benzamide

Systemtic Name: N-[[4-(5-bromanylpyrimidin-2-yl)oxy-3-(methylsulfanylmethyl)phenyl]carbamoyl]-2-(dimethylamino)benzamide Openeye Name: N-[[4-(5-bromopyrimidin-2-yl)oxy-3-(methylsulfanylmethyl)phenyl]carbamoyl]-2-(dimethylamino)benzamide CAS Name: N-[[4-[(5-bromo-2-pyrimidinyl)oxy]-3-[(methylthio)methyl]anilino]-oxomethyl]-2-(dimethylamino)benzamide IUPAC Name: N-[[4-(5-bromopyrimidin-2-yl)oxy-3-(methylsulfanylmethyl)phenyl]carbamoyl]-2-(dimethylamino)benzamide Traditional Name: N-[[4-(5-bromopyrimidin-2-yl)oxy-3-[(methylthio)methyl]phenyl]carbamoyl]-2-(dimethylamino)benzamide Formula: C22H22BrN5O3S MolecularWeight: 516.41078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC=C1C(=O)NC(=O)NC2=CC(=C(C=C2)OC3=NC=C(C=N3)Br)CSC

Isomeric SMILES

CN(C)C1=CC=CC=C1C(=O)NC(=O)NC2=CC(=C(C=C2)OC3=NC=C(C=N3)Br)CSC

InChI

InChI=1S/C22H22BrN5O3S/c1-28(2)18-7-5-4-6-17(18)20(29)27-21(30)26-16-8-9-19(14(10-16)13-32-3)31-22-24-11-15(23)12-25-22/h4-12H,13H2,1-3H3,(H2,26,27,29,30)