N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2-bromanyl-benzamide

Systemtic Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2-bromanyl-benzamide Openeye Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2-bromo-benzamide CAS Name: N-[3-[[4-(4-acetamidophenyl)-2-pyrimidinyl]amino]phenyl]-2-bromobenzamide IUPAC Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2-bromobenzamide Traditional Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2-bromo-benzamide Formula: C25H20BrN5O2 MolecularWeight: 502.3626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C25H20BrN5O2/c1-16(32)28-18-11-9-17(10-12-18)23-13-14-27-25(31-23)30-20-6-4-5-19(15-20)29-24(33)21-7-2-3-8-22(21)26/h2-15H,1H3,(H,28,32)(H,29,33)(H,27,30,31)