4-bromanyl-N-[4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]phenyl]benzamide Openeye Name: 4-bromo-N-[4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: 4-bromo-N-[4-[[4-(dimethylamino)-6-methyl-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 4-bromo-N-[4-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]amino]phenyl]benzamide Traditional Name: 4-bromo-N-[4-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]amino]phenyl]benzamide Formula: C20H20BrN5O MolecularWeight: 426.3097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)Br)N(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)Br)N(C)C

InChI

InChI=1S/C20H20BrN5O/c1-13-12-18(26(2)3)25-20(22-13)24-17-10-8-16(9-11-17)23-19(27)14-4-6-15(21)7-5-14/h4-12H,1-3H3,(H,23,27)(H,22,24,25)