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

Systemtic Name: 2-[[5,6-dimethyl-7-(6-methylpyridin-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[5,6-dimethyl-7-(6-methyl-2-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[5,6-dimethyl-7-(6-methyl-2-pyridinyl)-4-pyrrolo[2,3-d]pyrimidinyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5,6-dimethyl-7-(6-methylpyridin-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5,6-dimethyl-7-(6-methyl-2-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium Formula: C18H25N6+ MolecularWeight: 325.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2C(=C(C3=C2N=CN=C3NCC[NH+](C)C)C)C

Isomeric SMILES

CC1=NC(=CC=C1)N2C(=C(C3=C2N=CN=C3NCC[NH+](C)C)C)C

InChI

InChI=1S/C18H24N6/c1-12-7-6-8-15(22-12)24-14(3)13(2)16-17(19-9-10-23(4)5)20-11-21-18(16)24/h6-8,11H,9-10H2,1-5H3,(H,19,20,21)/p+1