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

Systemtic Name: 7-(4-methoxyphenyl)-5,6-dimethyl-3-(pyridin-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine Openeye Name: 7-(4-methoxyphenyl)-5,6-dimethyl-3-(2-pyridylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine CAS Name: 7-(4-methoxyphenyl)-5,6-dimethyl-3-(2-pyridinylmethyl)-4-pyrrolo[2,3-d]pyrimidinimine IUPAC Name: 7-(4-methoxyphenyl)-5,6-dimethyl-3-(pyridin-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine Traditional Name: [7-(4-methoxyphenyl)-5,6-dimethyl-3-(2-pyridylmethyl)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:

CC1=C(N(C2=C1C(=N)N(C=N2)CC3=CC=CC=N3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(N(C2=C1C(=N)N(C=N2)CC3=CC=CC=N3)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C21H21N5O/c1-14-15(2)26(17-7-9-18(27-3)10-8-17)21-19(14)20(22)25(13-24-21)12-16-6-4-5-11-23-16/h4-11,13,22H,12H2,1-3H3