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

Systemtic Name: 3-[[5,6-dimethyl-7-(6-methylpyridin-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[5,6-dimethyl-7-(6-methyl-2-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[5,6-dimethyl-7-(6-methyl-2-pyridinyl)-4-pyrrolo[2,3-d]pyrimidinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[5,6-dimethyl-7-(6-methylpyridin-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[5,6-dimethyl-7-(6-methyl-2-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]propyl-dimethyl-ammonium Formula: C19H27N6+ MolecularWeight: 339.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2C(=C(C3=C2N=CN=C3NCCC[NH+](C)C)C)C

Isomeric SMILES

CC1=NC(=CC=C1)N2C(=C(C3=C2N=CN=C3NCCC[NH+](C)C)C)C

InChI

InChI=1S/C19H26N6/c1-13-8-6-9-16(23-13)25-15(3)14(2)17-18(21-12-22-19(17)25)20-10-7-11-24(4)5/h6,8-9,12H,7,10-11H2,1-5H3,(H,20,21,22)/p+1