2-[4-azanyl-5,6-dimethyl-7-(1,3-thiazol-2-yl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]ethanol

Systemtic Name: 2-[4-azanyl-5,6-dimethyl-7-(1,3-thiazol-2-yl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]ethanol Openeye Name: 2-(4-amino-5,6-dimethyl-7-thiazol-2-yl-pyrrolo[2,3-d]pyrimidin-3-ium-3-yl)ethanol CAS Name: 2-[4-amino-5,6-dimethyl-7-(2-thiazolyl)-3-pyrrolo[2,3-d]pyrimidin-3-iumyl]ethanol IUPAC Name: 2-[4-amino-5,6-dimethyl-7-(1,3-thiazol-2-yl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]ethanol Traditional Name: 2-(4-amino-5,6-dimethyl-7-thiazol-2-yl-pyrrolo[2,3-d]pyrimidin-3-ium-3-yl)ethanol Formula: C13H16N5OS+ MolecularWeight: 290.36404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=[N+](C=N2)CCO)N)C3=NC=CS3)C

Isomeric SMILES

CC1=C(N(C2=C1C(=[N+](C=N2)CCO)N)C3=NC=CS3)C

InChI

InChI=1S/C13H15N5OS/c1-8-9(2)18(13-15-3-6-20-13)12-10(8)11(14)17(4-5-19)7-16-12/h3,6-7,14,19H,4-5H2,1-2H3/p+1