3-[4-azanyl-7-[1-(2-imidazol-1-ylethyl)piperidin-4-yl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol

Systemtic Name: 3-[4-azanyl-7-[1-(2-imidazol-1-ylethyl)piperidin-4-yl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol Openeye Name: 3-[4-amino-7-[1-(2-imidazol-1-ylethyl)-4-piperidyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol CAS Name: 3-[4-amino-7-[1-[2-(1-imidazolyl)ethyl]-4-piperidinyl]-5-pyrrolo[2,3-d]pyrimidinyl]phenol IUPAC Name: 3-[4-amino-7-[1-(2-imidazol-1-ylethyl)piperidin-4-yl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol Traditional Name: 3-[4-amino-7-[1-(2-imidazol-1-ylethyl)-4-piperidyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol Formula: C22H25N7O MolecularWeight: 403.4802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)O)CCN5C=CN=C5

Isomeric SMILES

C1CN(CCC1N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)O)CCN5C=CN=C5

InChI

InChI=1S/C22H25N7O/c23-21-20-19(16-2-1-3-18(30)12-16)13-29(22(20)26-14-25-21)17-4-7-27(8-5-17)10-11-28-9-6-24-15-28/h1-3,6,9,12-15,17,30H,4-5,7-8,10-11H2,(H2,23,25,26)