[methyl(oxidanyl)phosphoryl]phosphonic acid; 3-methylsulfanyl-1H-pyrrole

Systemtic Name: [methyl(oxidanyl)phosphoryl]phosphonic acid; 3-methylsulfanyl-1H-pyrrole Openeye Name: [hydroxy(methyl)phosphoryl]phosphonic acid; 3-methylsulfanyl-1H-pyrrole CAS Name: [hydroxy(methyl)phosphoryl]phosphonic acid; 3-(methylthio)-1H-pyrrole IUPAC Name: [hydroxy(methyl)phosphoryl]phosphonic acid; 3-methylsulfanyl-1H-pyrrole Traditional Name: [hydroxy(methyl)phosphoryl]phosphonic acid; 3-(methylthio)-1H-pyrrole Formula: C6H13NO5P2S MolecularWeight: 273.183642

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Descriptors Computed from Structure

Canonical SMILES:

CP(=O)(O)P(=O)(O)O.CSC1=CNC=C1

Isomeric SMILES

CP(=O)(O)P(=O)(O)O.CSC1=CNC=C1

InChI

InChI=1S/C5H7NS.CH6O5P2/c1-7-5-2-3-6-4-5;1-7(2,3)8(4,5)6/h2-4,6H,1H3;1H3,(H,2,3)(H2,4,5,6)