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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)NCC3=CC=NC=C3)CCC[NH+](C)C)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)NCC3=CC=NC=C3)CCC[NH+](C)C)C

InChI

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