N-[3-[(2-azanylpyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-4-bromanyl-3,5-dimethoxy-benzamide

Systemtic Name: N-[3-[(2-azanylpyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-4-bromanyl-3,5-dimethoxy-benzamide Openeye Name: N-[3-[(2-aminopyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-4-bromo-3,5-dimethoxy-benzamide CAS Name: N-[3-[[(2-amino-5-pyrimidinyl)amino]-oxomethyl]-4-methylphenyl]-4-bromo-3,5-dimethoxybenzamide IUPAC Name: N-[3-[(2-aminopyrimidin-5-yl)carbamoyl]-4-methylphenyl]-4-bromo-3,5-dimethoxybenzamide Traditional Name: N-[3-[(2-aminopyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-4-bromo-3,5-dimethoxy-benzamide Formula: C21H20BrN5O4 MolecularWeight: 486.3186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C(=C2)OC)Br)OC)C(=O)NC3=CN=C(N=C3)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C(=C2)OC)Br)OC)C(=O)NC3=CN=C(N=C3)N

InChI

InChI=1S/C21H20BrN5O4/c1-11-4-5-13(8-15(11)20(29)27-14-9-24-21(23)25-10-14)26-19(28)12-6-16(30-2)18(22)17(7-12)31-3/h4-10H,1-3H3,(H,26,28)(H,27,29)(H2,23,24,25)