N-[5-bromanyl-7-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-4-yl]benzamide

Systemtic Name: N-[5-bromanyl-7-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-4-yl]benzamide Openeye Name: N-[5-bromo-7-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidin-4-yl]benzamide CAS Name: N-[5-bromo-7-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-pyrrolo[2,3-d]pyrimidinyl]benzamide IUPAC Name: N-[5-bromo-7-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-4-yl]benzamide Traditional Name: N-[5-bromo-7-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]benzamide Formula: C18H17BrN4O4 MolecularWeight: 433.25598

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C3=C2N=CN=C3NC(=O)C4=CC=CC=C4)Br)CO)O

Isomeric SMILES

C1C(C(OC1N2C=C(C3=C2N=CN=C3NC(=O)C4=CC=CC=C4)Br)CO)O

InChI

InChI=1S/C18H17BrN4O4/c19-11-7-23(14-6-12(25)13(8-24)27-14)17-15(11)16(20-9-21-17)22-18(26)10-4-2-1-3-5-10/h1-5,7,9,12-14,24-25H,6,8H2,(H,20,21,22,26)