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

Systemtic Name: 7-(5-bromanylpyridin-2-yl)-3-(furan-2-ylmethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 7-(5-bromo-2-pyridyl)-3-(2-furylmethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 7-(5-bromo-2-pyridinyl)-3-(2-furanylmethyl)-5,6-dimethyl-4-pyrrolo[2,3-d]pyrimidin-3-iumamine IUPAC Name: 7-(5-bromopyridin-2-yl)-3-(furan-2-ylmethyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: [7-(5-bromo-2-pyridyl)-3-(2-furfuryl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-4-yl]amine Formula: C18H17BrN5O+ MolecularWeight: 399.26448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=[N+](C=N2)CC3=CC=CO3)N)C4=NC=C(C=C4)Br)C

Isomeric SMILES

CC1=C(N(C2=C1C(=[N+](C=N2)CC3=CC=CO3)N)C4=NC=C(C=C4)Br)C

InChI

InChI=1S/C18H16BrN5O/c1-11-12(2)24(15-6-5-13(19)8-21-15)18-16(11)17(20)23(10-22-18)9-14-4-3-7-25-14/h3-8,10,20H,9H2,1-2H3/p+1