2-[[3-(2-imidazol-1-ylethoxy)phenyl]amino]-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-6-one

Systemtic Name: 2-[[3-(2-imidazol-1-ylethoxy)phenyl]amino]-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-6-one Openeye Name: 7-(1-ethylpropyl)-2-[3-(2-imidazol-1-ylethoxy)anilino]-5H-pyrrolo[2,3-d]pyrimidin-6-one CAS Name: 2-[3-[2-(1-imidazolyl)ethoxy]anilino]-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-6-one IUPAC Name: 2-[3-(2-imidazol-1-ylethoxy)anilino]-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-6-one Traditional Name: 7-(1-ethylpropyl)-2-[3-(2-imidazol-1-ylethoxy)anilino]-5H-pyrrolo[2,3-d]pyrimidin-6-one Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=O)CC2=CN=C(N=C21)NC3=CC(=CC=C3)OCCN4C=CN=C4

Isomeric SMILES

CCC(CC)N1C(=O)CC2=CN=C(N=C21)NC3=CC(=CC=C3)OCCN4C=CN=C4

InChI

InChI=1S/C22H26N6O2/c1-3-18(4-2)28-20(29)12-16-14-24-22(26-21(16)28)25-17-6-5-7-19(13-17)30-11-10-27-9-8-23-15-27/h5-9,13-15,18H,3-4,10-12H2,1-2H3,(H,24,25,26)