4-azanyl-6-bromanyl-7-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-6-bromanyl-7-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4-amino-6-bromo-7-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4-amino-6-bromo-7-[(2R,5S)-5-(hydroxymethyl)-2-oxolanyl]-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-6-bromo-7-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4-amino-6-bromo-7-[(2R,5S)-5-methyloltetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C12H12BrN5O2 MolecularWeight: 338.15998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1CO)N2C3=C(C(=C2Br)C#N)C(=NC=N3)N

Isomeric SMILES

C1C[C@@H](O[C@@H]1CO)N2C3=C(C(=C2Br)C#N)C(=NC=N3)N

InChI

InChI=1S/C12H12BrN5O2/c13-10-7(3-14)9-11(15)16-5-17-12(9)18(10)8-2-1-6(4-19)20-8/h5-6,8,19H,1-2,4H2,(H2,15,16,17)/t6-,8+/m0/s1