4-azanyl-N'-cyano-7-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrrolo[2,3-d][1,2,3]triazine-5-carboximidamide

Systemtic Name: 4-azanyl-N'-cyano-7-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrrolo[2,3-d][1,2,3]triazine-5-carboximidamide Openeye Name: 4-amino-N'-cyano-7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]triazine-5-carboxamidine CAS Name: 4-amino-N'-cyano-7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-pyrrolo[2,3-d]triazinecarboximidamide IUPAC Name: 4-amino-N'-cyano-7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]triazine-5-carboximidamide Traditional Name: 4-amino-N'-cyano-7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]pyrrolo[2,3-d]triazine-5-carboxamidine Formula: C12H14N8O4 MolecularWeight: 334.29076

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(N1C3C(C(C(O3)CO)O)O)N=NN=C2N)C(=NC#N)N

Isomeric SMILES

C1=C(C2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=NN=C2N)C(=NC#N)N

InChI

InChI=1S/C12H14N8O4/c13-3-16-9(14)4-1-20(11-6(4)10(15)17-19-18-11)12-8(23)7(22)5(2-21)24-12/h1,5,7-8,12,21-23H,2H2,(H2,14,16)(H2,15,17,18)/t5-,7-,8-,12-/m1/s1