ethyl 2-[4-[(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]phenyl]acetate CAS Name: 2-[4-[(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]phenyl]acetate Traditional Name: 2-[4-[(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]phenyl]acetic acid ethyl ester Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)NC2=NC=NC3=C2C(=CN3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)NC2=NC=NC3=C2C(=CN3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2/c1-2-28-19(27)12-15-8-10-17(11-9-15)26-22-20-18(16-6-4-3-5-7-16)13-23-21(20)24-14-25-22/h3-11,13-14H,2,12H2,1H3,(H2,23,24,25,26)