2-[[3-(4-azanyl-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)phenyl]methylamino]ethanol

Systemtic Name: 2-[[3-(4-azanyl-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)phenyl]methylamino]ethanol Openeye Name: 2-[[3-(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)phenyl]methylamino]ethanol CAS Name: 2-[[3-(4-amino-5-phenyl-7-pyrrolo[2,3-d]pyrimidinyl)phenyl]methylamino]ethanol IUPAC Name: 2-[[3-(4-amino-5-phenylpyrrolo[2,3-d]pyrimidin-7-yl)phenyl]methylamino]ethanol Traditional Name: 2-[[3-(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)benzyl]amino]ethanol Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)N)C4=CC=CC(=C4)CNCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)N)C4=CC=CC(=C4)CNCCO

InChI

InChI=1S/C21H21N5O/c22-20-19-18(16-6-2-1-3-7-16)13-26(21(19)25-14-24-20)17-8-4-5-15(11-17)12-23-9-10-27/h1-8,11,13-14,23,27H,9-10,12H2,(H2,22,24,25)