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

Systemtic Name: 5,6-dimethyl-7-(2-methylpropyl)-3-(pyridin-4-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine Openeye Name: 7-isobutyl-5,6-dimethyl-3-(4-pyridylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine CAS Name: 5,6-dimethyl-7-(2-methylpropyl)-3-(pyridin-4-ylmethyl)-4-pyrrolo[2,3-d]pyrimidinimine IUPAC Name: 5,6-dimethyl-7-(2-methylpropyl)-3-(pyridin-4-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine Traditional Name: [7-isobutyl-5,6-dimethyl-3-(4-pyridylmethyl)pyrrolo[2,3-d]pyrimidin-4-ylidene]amine Formula: C18H23N5 MolecularWeight: 309.40872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=N)N(C=N2)CC3=CC=NC=C3)CC(C)C)C

Isomeric SMILES

CC1=C(N(C2=C1C(=N)N(C=N2)CC3=CC=NC=C3)CC(C)C)C

InChI

InChI=1S/C18H23N5/c1-12(2)9-23-14(4)13(3)16-17(19)22(11-21-18(16)23)10-15-5-7-20-8-6-15/h5-8,11-12,19H,9-10H2,1-4H3