(1R)-1-(3-methyl-1H-imidazol-3-ium-2-yl)-2-(thieno[2,3-d]pyrimidin-4-ylamino)ethanol

Systemtic Name: (1R)-1-(3-methyl-1H-imidazol-3-ium-2-yl)-2-(thieno[2,3-d]pyrimidin-4-ylamino)ethanol Openeye Name: (1R)-1-(3-methyl-1H-imidazol-3-ium-2-yl)-2-(thieno[2,3-d]pyrimidin-4-ylamino)ethanol CAS Name: (1R)-1-(3-methyl-1H-imidazol-3-ium-2-yl)-2-(4-thieno[2,3-d]pyrimidinylamino)ethanol IUPAC Name: (1R)-1-(3-methyl-1H-imidazol-3-ium-2-yl)-2-(thieno[2,3-d]pyrimidin-4-ylamino)ethanol Traditional Name: (1R)-1-(3-methyl-1H-imidazol-3-ium-2-yl)-2-(thieno[2,3-d]pyrimidin-4-ylamino)ethanol Formula: C12H14N5OS+ MolecularWeight: 276.33746

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)C(CNC2=C3C=CSC3=NC=N2)O

Isomeric SMILES

C[N+]1=C(NC=C1)[C@@H](CNC2=C3C=CSC3=NC=N2)O

InChI

InChI=1S/C12H13N5OS/c1-17-4-3-13-11(17)9(18)6-14-10-8-2-5-19-12(8)16-7-15-10/h2-5,7,9,18H,6H2,1H3,(H,14,15,16)/p+1/t9-/m1/s1