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

Systemtic Name: 2-[(5,6-dimethyl-7-pyridin-3-yl-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[[5,6-dimethyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[5,6-dimethyl-7-(3-pyridinyl)-4-pyrrolo[2,3-d]pyrimidinyl]amino]ethyl-diethylammonium IUPAC Name: 2-[(5,6-dimethyl-7-pyridin-3-ylpyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl-diethylazanium Traditional Name: 2-[[5,6-dimethyl-7-(3-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-diethyl-ammonium Formula: C19H27N6+ MolecularWeight: 339.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=NC=NC2=C1C(=C(N2C3=CN=CC=C3)C)C

Isomeric SMILES

CC[NH+](CC)CCNC1=NC=NC2=C1C(=C(N2C3=CN=CC=C3)C)C

InChI

InChI=1S/C19H26N6/c1-5-24(6-2)11-10-21-18-17-14(3)15(4)25(19(17)23-13-22-18)16-8-7-9-20-12-16/h7-9,12-13H,5-6,10-11H2,1-4H3,(H,21,22,23)/p+1