4-(7-chloranyl-5-propylsulfanyl-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)spiro[2.4]hept-5-en-7-ol

Systemtic Name: 4-(7-chloranyl-5-propylsulfanyl-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)spiro[2.4]hept-5-en-7-ol Openeye Name: 4-(7-chloro-5-propylsulfanyl-triazolo[4,5-d]pyrimidin-3-yl)spiro[2.4]hept-5-en-7-ol CAS Name: 4-[7-chloro-5-(propylthio)-3-triazolo[4,5-d]pyrimidinyl]-7-spiro[2.4]hept-5-enol IUPAC Name: 4-(7-chloro-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl)spiro[2.4]hept-5-en-7-ol Traditional Name: 4-[7-chloro-5-(propylthio)triazolo[4,5-d]pyrimidin-3-yl]spiro[2.4]hept-5-en-7-ol Formula: C14H16ClN5OS MolecularWeight: 337.82774

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C(=N1)Cl)N=NN2C3C=CC(C34CC4)O

Isomeric SMILES

CCCSC1=NC2=C(C(=N1)Cl)N=NN2C3C=CC(C34CC4)O

InChI

InChI=1S/C14H16ClN5OS/c1-2-7-22-13-16-11(15)10-12(17-13)20(19-18-10)8-3-4-9(21)14(8)5-6-14/h3-4,8-9,21H,2,5-7H2,1H3