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

Systemtic Name: 3-(furan-2-ylmethyl)-5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 3-(2-furylmethyl)-5,6-dimethyl-7-(3-morpholinopropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 3-(2-furanylmethyl)-5,6-dimethyl-7-[3-(4-morpholinyl)propyl]-4-pyrrolo[2,3-d]pyrimidin-3-iumamine IUPAC Name: 3-(furan-2-ylmethyl)-5,6-dimethyl-7-(3-morpholin-4-ylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: [3-(2-furfuryl)-5,6-dimethyl-7-(3-morpholinopropyl)pyrrolo[2,3-d]pyrimidin-3-ium-4-yl]amine Formula: C20H28N5O2+ MolecularWeight: 370.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=[N+](C=N2)CC3=CC=CO3)N)CCCN4CCOCC4)C

Isomeric SMILES

CC1=C(N(C2=C1C(=[N+](C=N2)CC3=CC=CO3)N)CCCN4CCOCC4)C

InChI

InChI=1S/C20H27N5O2/c1-15-16(2)25(7-4-6-23-8-11-26-12-9-23)20-18(15)19(21)24(14-22-20)13-17-5-3-10-27-17/h3,5,10,14,21H,4,6-9,11-13H2,1-2H3/p+1