3-[2-(3,4-diethoxyphenyl)ethyl]-5,6-dimethyl-7-pyridin-3-yl-pyrrolo[2,3-d]pyrimidin-4-imine

Systemtic Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-5,6-dimethyl-7-pyridin-3-yl-pyrrolo[2,3-d]pyrimidin-4-imine Openeye Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-5,6-dimethyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-imine CAS Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-5,6-dimethyl-7-(3-pyridinyl)-4-pyrrolo[2,3-d]pyrimidinimine IUPAC Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-5,6-dimethyl-7-pyridin-3-ylpyrrolo[2,3-d]pyrimidin-4-imine Traditional Name: [3-[2-(3,4-diethoxyphenyl)ethyl]-5,6-dimethyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-ylidene]amine Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCN2C=NC3=C(C2=N)C(=C(N3C4=CN=CC=C4)C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCN2C=NC3=C(C2=N)C(=C(N3C4=CN=CC=C4)C)C)OCC

InChI

InChI=1S/C25H29N5O2/c1-5-31-21-10-9-19(14-22(21)32-6-2)11-13-29-16-28-25-23(24(29)26)17(3)18(4)30(25)20-8-7-12-27-15-20/h7-10,12,14-16,26H,5-6,11,13H2,1-4H3