2-[[ethoxy(oxidanyl)phosphinothioyl]sulfanylmethyl]-2-propan-2-yl-1H-pyridazin-2-ium-3,6-dione

Systemtic Name: 2-[[ethoxy(oxidanyl)phosphinothioyl]sulfanylmethyl]-2-propan-2-yl-1H-pyridazin-2-ium-3,6-dione Openeye Name: 2-[[ethoxy(hydroxy)phosphinothioyl]sulfanylmethyl]-2-isopropyl-1H-pyridazin-2-ium-3,6-dione CAS Name: 2-[[[ethoxy(hydroxy)phosphinothioyl]thio]methyl]-2-propan-2-yl-1H-pyridazin-2-ium-3,6-dione IUPAC Name: 2-[[ethoxy(hydroxy)phosphinothioyl]sulfanylmethyl]-2-propan-2-yl-1H-pyridazin-2-ium-3,6-dione Traditional Name: 2-[[[ethoxy(hydroxy)thiophosphoryl]thio]methyl]-2-isopropyl-1H-pyridazin-2-ium-3,6-quinone Formula: C10H18N2O4PS2+ MolecularWeight: 325.364681

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(O)SC[N+]1(C(=O)C=CC(=O)N1)C(C)C

Isomeric SMILES

CCOP(=S)(O)SC[N+]1(C(=O)C=CC(=O)N1)C(C)C

InChI

InChI=1S/C10H17N2O4PS2/c1-4-16-17(15,18)19-7-12(8(2)3)10(14)6-5-9(13)11-12/h5-6,8H,4,7H2,1-3H3,(H-,11,13,15,18)/p+1