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

Systemtic Name: 4-azanyl-7-[(2S,3S,4R,5R)-3-fluoranyl-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4-amino-7-[(2S,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4-amino-7-[(2S,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-7-[(2S,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4-amino-7-[(2S,3S,4R,5R)-3-fluoro-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C12H12FN5O3 MolecularWeight: 293.253783

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(N1C3C(C(C(O3)CO)O)F)N=CN=C2N)C#N

Isomeric SMILES

C1=C(C2=C(N1[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)F)N=CN=C2N)C#N

InChI

InChI=1S/C12H12FN5O3/c13-8-9(20)6(3-19)21-12(8)18-2-5(1-14)7-10(15)16-4-17-11(7)18/h2,4,6,8-9,12,19-20H,3H2,(H2,15,16,17)/t6-,8+,9-,12+/m1/s1