3-aminocarbonyl-2-methylsulfanyl-5-(prop-2-enoxymethyl)pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 3-aminocarbonyl-2-methylsulfanyl-5-(prop-2-enoxymethyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 5-(allyloxymethyl)-3-carbamoyl-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 3-carbamoyl-2-(methylthio)-5-(prop-2-enoxymethyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 3-carbamoyl-2-methylsulfanyl-5-(prop-2-enoxymethyl)pyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 5-(allyloxymethyl)-3-carbamoyl-2-(methylthio)pyrazolo[1,5-a]pyrimidin-7-olate Formula: C12H13N4O3S- MolecularWeight: 293.32162

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN2C(=CC(=NC2=C1C(=O)N)COCC=C)[O-]

Isomeric SMILES

CSC1=NN2C(=CC(=NC2=C1C(=O)N)COCC=C)[O-]

InChI

InChI=1S/C12H14N4O3S/c1-3-4-19-6-7-5-8(17)16-11(14-7)9(10(13)18)12(15-16)20-2/h3,5,17H,1,4,6H2,2H3,(H2,13,18)/p-1