4-(2-azanylpyrimidin-4-yl)-N-[(3-bromophenyl)methyl]benzamide

Systemtic Name: 4-(2-azanylpyrimidin-4-yl)-N-[(3-bromophenyl)methyl]benzamide Openeye Name: 4-(2-aminopyrimidin-4-yl)-N-[(3-bromophenyl)methyl]benzamide CAS Name: 4-(2-amino-4-pyrimidinyl)-N-[(3-bromophenyl)methyl]benzamide IUPAC Name: 4-(2-aminopyrimidin-4-yl)-N-[(3-bromophenyl)methyl]benzamide Traditional Name: 4-(2-aminopyrimidin-4-yl)-N-(3-bromobenzyl)benzamide Formula: C18H15BrN4O MolecularWeight: 383.2419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CNC(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)CNC(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)N

InChI

InChI=1S/C18H15BrN4O/c19-15-3-1-2-12(10-15)11-22-17(24)14-6-4-13(5-7-14)16-8-9-21-18(20)23-16/h1-10H,11H2,(H,22,24)(H2,20,21,23)