[ethoxy(oxidanyl)phosphoryl] ethyl hydrogen phosphate; ethyl carbamimidothioate

Systemtic Name: [ethoxy(oxidanyl)phosphoryl] ethyl hydrogen phosphate; ethyl carbamimidothioate Openeye Name: [ethoxy(hydroxy)phosphoryl] ethyl hydrogen phosphate; 2-ethylisothiourea CAS Name: carbamimidothioic acid ethyl ester; [ethoxy(hydroxy)phosphoryl] ethyl hydrogen phosphate IUPAC Name: [ethoxy(hydroxy)phosphoryl] ethyl hydrogen phosphate; ethyl carbamimidothioate Traditional Name: [ethoxy(hydroxy)phosphoryl] ethyl hydrogen phosphate; 2-ethylisothiourea Formula: C10H28N4O7P2S2 MolecularWeight: 442.429442

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(O)OP(=O)(O)OCC.CCSC(=N)N.CCSC(=N)N

Isomeric SMILES

CCOP(=O)(O)OP(=O)(O)OCC.CCSC(=N)N.CCSC(=N)N

InChI

InChI=1S/C4H12O7P2.2C3H8N2S/c1-3-9-12(5,6)11-13(7,8)10-4-2;2*1-2-6-3(4)5/h3-4H2,1-2H3,(H,5,6)(H,7,8);2*2H2,1H3,(H3,4,5)