2-[4-(7-bromanyl-5-propylsulfanyl-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]ethanol

Systemtic Name: 2-[4-(7-bromanyl-5-propylsulfanyl-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]ethanol Openeye Name: 2-[4-(7-bromo-5-propylsulfanyl-triazolo[4,5-d]pyrimidin-3-yl)-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]ethanol CAS Name: 2-[4-[7-bromo-5-(propylthio)-3-triazolo[4,5-d]pyrimidinyl]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]ethanol IUPAC Name: 2-[4-(7-bromo-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl)-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]ethanol Traditional Name: 2-[4-[7-bromo-5-(propylthio)triazolo[4,5-d]pyrimidin-3-yl]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]ethanol Formula: C17H24BrN5O3S MolecularWeight: 458.37316

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C(=N1)Br)N=NN2C3CC(C4C3OC(O4)(C)C)CCO

Isomeric SMILES

CCCSC1=NC2=C(C(=N1)Br)N=NN2C3CC(C4C3OC(O4)(C)C)CCO

InChI

InChI=1S/C17H24BrN5O3S/c1-4-7-27-16-19-14(18)11-15(20-16)23(22-21-11)10-8-9(5-6-24)12-13(10)26-17(2,3)25-12/h9-10,12-13,24H,4-8H2,1-3H3