9-[[1-bromanyl-2-fluoranyl-3-(phenylmethoxymethyl)cyclopropyl]methyl]-6-chloranyl-purin-2-amine

Systemtic Name: 9-[[1-bromanyl-2-fluoranyl-3-(phenylmethoxymethyl)cyclopropyl]methyl]-6-chloranyl-purin-2-amine Openeye Name: 9-[[2-(benzyloxymethyl)-1-bromo-3-fluoro-cyclopropyl]methyl]-6-chloro-purin-2-amine CAS Name: 9-[[1-bromo-2-fluoro-3-(phenylmethoxymethyl)cyclopropyl]methyl]-6-chloro-2-purinamine IUPAC Name: 9-[[1-bromo-2-fluoro-3-(phenylmethoxymethyl)cyclopropyl]methyl]-6-chloropurin-2-amine Traditional Name: [9-[[2-(benzoxymethyl)-1-bromo-3-fluoro-cyclopropyl]methyl]-6-chloro-purin-2-yl]amine Formula: C17H16BrClFN5O MolecularWeight: 440.697243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C(C2(CN3C=NC4=C3N=C(N=C4Cl)N)Br)F

Isomeric SMILES

C1=CC=C(C=C1)COCC2C(C2(CN3C=NC4=C3N=C(N=C4Cl)N)Br)F

InChI

InChI=1S/C17H16BrClFN5O/c18-17(8-25-9-22-12-14(19)23-16(21)24-15(12)25)11(13(17)20)7-26-6-10-4-2-1-3-5-10/h1-5,9,11,13H,6-8H2,(H2,21,23,24)