(2R,3R,4S,5R)-2-[6-azanyl-8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: (2R,3R,4S,5R)-2-[6-azanyl-8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: (2R,3R,4S,5R)-2-[6-amino-8-[(2E)-2-[(4-bromophenyl)methylene]hydrazino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: (2R,3R,4S,5R)-2-[6-amino-8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: (2R,3R,4S,5R)-2-[6-amino-8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: (2R,3R,4S,5R)-2-[6-amino-8-[(N'E)-N'-(4-bromobenzylidene)hydrazino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H18BrN7O4 MolecularWeight: 464.27332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC2=NC3=C(N2C4C(C(C(O4)CO)O)O)N=CN=C3N)Br

Isomeric SMILES

C1=CC(=CC=C1/C=N/NC2=NC3=C(N2[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N=CN=C3N)Br

InChI

InChI=1S/C17H18BrN7O4/c18-9-3-1-8(2-4-9)5-22-24-17-23-11-14(19)20-7-21-15(11)25(17)16-13(28)12(27)10(6-26)29-16/h1-5,7,10,12-13,16,26-28H,6H2,(H,23,24)(H2,19,20,21)/b22-5+/t10-,12-,13-,16-/m1/s1