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

Systemtic Name: 2-[(5,6-dimethyl-7-pyridin-3-yl-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[[5,6-dimethyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[5,6-dimethyl-7-(3-pyridinyl)-4-pyrrolo[2,3-d]pyrimidinyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5,6-dimethyl-7-pyridin-3-ylpyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[[5,6-dimethyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium Formula: C17H23N6+ MolecularWeight: 311.40472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)NCC[NH+](C)C)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)NCC[NH+](C)C)C3=CN=CC=C3)C

InChI

InChI=1S/C17H22N6/c1-12-13(2)23(14-6-5-7-18-10-14)17-15(12)16(20-11-21-17)19-8-9-22(3)4/h5-7,10-11H,8-9H2,1-4H3,(H,19,20,21)/p+1