N-(3-bromophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine

Systemtic Name: N-(3-bromophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Openeye Name: N-(3-bromophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine CAS Name: N-(3-bromophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-2-pyrimidinamine IUPAC Name: N-(3-bromophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Traditional Name: (3-bromophenyl)-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]amine Formula: C17H12BrN5 MolecularWeight: 366.21468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NC=CC(=N2)C3=CNC4=C3C=CC=N4

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NC=CC(=N2)C3=CNC4=C3C=CC=N4

InChI

InChI=1S/C17H12BrN5/c18-11-3-1-4-12(9-11)22-17-20-8-6-15(23-17)14-10-21-16-13(14)5-2-7-19-16/h1-10H,(H,19,21)(H,20,22,23)