butyl carbamimidothioate; dibutyl hydrogen phosphate

Systemtic Name: butyl carbamimidothioate; dibutyl hydrogen phosphate Openeye Name: 2-butylisothiourea; dibutyl hydrogen phosphate CAS Name: carbamimidothioic acid butyl ester; dibutyl hydrogen phosphate IUPAC Name: butyl carbamimidothioate; dibutyl hydrogen phosphate Traditional Name: 2-butylisothiourea; dibutyl hydrogen phosphate Formula: C13H31N2O4PS MolecularWeight: 342.435001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(O)OCCCC.CCCCSC(=N)N

Isomeric SMILES

CCCCOP(=O)(O)OCCCC.CCCCSC(=N)N

InChI

InChI=1S/C8H19O4P.C5H12N2S/c1-3-5-7-11-13(9,10)12-8-6-4-2;1-2-3-4-8-5(6)7/h3-8H2,1-2H3,(H,9,10);2-4H2,1H3,(H3,6,7)