4-azanyl-6-bromanyl-7-[(1S,4R)-4-oxidanylcyclopent-2-en-1-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-6-bromanyl-7-[(1S,4R)-4-oxidanylcyclopent-2-en-1-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4-amino-6-bromo-7-[(1S,4R)-4-hydroxycyclopent-2-en-1-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4-amino-6-bromo-7-[(1S,4R)-4-hydroxy-1-cyclopent-2-enyl]-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-6-bromo-7-[(1S,4R)-4-hydroxycyclopent-2-en-1-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4-amino-6-bromo-7-[(1S,4R)-4-hydroxycyclopent-2-en-1-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C12H10BrN5O MolecularWeight: 320.1447

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1O)N2C3=C(C(=C2Br)C#N)C(=NC=N3)N

Isomeric SMILES

C1[C@@H](C=C[C@@H]1O)N2C3=C(C(=C2Br)C#N)C(=NC=N3)N

InChI

InChI=1S/C12H10BrN5O/c13-10-8(4-14)9-11(15)16-5-17-12(9)18(10)6-1-2-7(19)3-6/h1-2,5-7,19H,3H2,(H2,15,16,17)/t6-,7+/m1/s1