2-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)phenoxy]phenol

Systemtic Name: 2-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)phenoxy]phenol Openeye Name: 2-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)phenoxy]phenol CAS Name: 2-[4-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)phenoxy]phenol IUPAC Name: 2-[4-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)phenoxy]phenol Traditional Name: 2-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)phenoxy]phenol Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5O

Isomeric SMILES

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5O

InChI

InChI=1S/C23H22N4O2/c24-22-21-18(13-27(16-5-1-2-6-16)23(21)26-14-25-22)15-9-11-17(12-10-15)29-20-8-4-3-7-19(20)28/h3-4,7-14,16,28H,1-2,5-6H2,(H2,24,25,26)