3-(furan-2-ylmethyl)-5,6-dimethyl-7-(2-methylphenyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine

Systemtic Name: 3-(furan-2-ylmethyl)-5,6-dimethyl-7-(2-methylphenyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 3-(2-furylmethyl)-5,6-dimethyl-7-(o-tolyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 3-(2-furanylmethyl)-5,6-dimethyl-7-(2-methylphenyl)-4-pyrrolo[2,3-d]pyrimidin-3-iumamine IUPAC Name: 3-(furan-2-ylmethyl)-5,6-dimethyl-7-(2-methylphenyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: [3-(2-furfuryl)-5,6-dimethyl-7-(o-tolyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-yl]amine Formula: C20H21N4O+ MolecularWeight: 333.40694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C3=C2N=C[N+](=C3N)CC4=CC=CO4)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C3=C2N=C[N+](=C3N)CC4=CC=CO4)C)C

InChI

InChI=1S/C20H20N4O/c1-13-7-4-5-9-17(13)24-15(3)14(2)18-19(21)23(12-22-20(18)24)11-16-8-6-10-25-16/h4-10,12,21H,11H2,1-3H3/p+1