[(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)-methylsulfanyl-methyl]phosphonic acid

Systemtic Name: [(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)-methylsulfanyl-methyl]phosphonic acid Openeye Name: [(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)-methylsulfanyl-methyl]phosphonic acid CAS Name: [(5-methyl-7-pyrazolo[1,5-a]pyrimidinyl)-(methylthio)methyl]phosphonic acid IUPAC Name: [(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)-methylsulfanylmethyl]phosphonic acid Traditional Name: [(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)-(methylthio)methyl]phosphonic acid Formula: C9H12N3O3PS MolecularWeight: 273.248641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=NN2C(=C1)C(P(=O)(O)O)SC

Isomeric SMILES

CC1=NC2=CC=NN2C(=C1)C(P(=O)(O)O)SC

InChI

InChI=1S/C9H12N3O3PS/c1-6-5-7(9(17-2)16(13,14)15)12-8(11-6)3-4-10-12/h3-5,9H,1-2H3,(H2,13,14,15)