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

Systemtic Name: 3-(4-ethoxyphenyl)-5,6-dimethyl-7-pyridin-3-yl-pyrrolo[2,3-d]pyrimidin-4-imine Openeye Name: 3-(4-ethoxyphenyl)-5,6-dimethyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-imine CAS Name: 3-(4-ethoxyphenyl)-5,6-dimethyl-7-(3-pyridinyl)-4-pyrrolo[2,3-d]pyrimidinimine IUPAC Name: 3-(4-ethoxyphenyl)-5,6-dimethyl-7-pyridin-3-ylpyrrolo[2,3-d]pyrimidin-4-imine Traditional Name: [5,6-dimethyl-3-p-phenetyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-ylidene]amine Formula: C21H21N5O MolecularWeight: 359.42434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C=NC3=C(C2=N)C(=C(N3C4=CN=CC=C4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C=NC3=C(C2=N)C(=C(N3C4=CN=CC=C4)C)C

InChI

InChI=1S/C21H21N5O/c1-4-27-18-9-7-16(8-10-18)25-13-24-21-19(20(25)22)14(2)15(3)26(21)17-6-5-11-23-12-17/h5-13,22H,4H2,1-3H3