diphenylphosphorylmethyl carbamimidothioate hydrochloride

Systemtic Name: diphenylphosphorylmethyl carbamimidothioate hydrochloride Openeye Name: 2-(diphenylphosphorylmethyl)isothiourea hydrochloride CAS Name: carbamimidothioic acid diphenylphosphorylmethyl ester hydrochloride IUPAC Name: diphenylphosphorylmethyl carbamimidothioate hydrochloride Traditional Name: 2-(diphenylphosphorylmethyl)isothiourea hydrochloride Formula: C14H16ClN2OPS MolecularWeight: 326.781401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=O)(CSC(=N)N)C2=CC=CC=C2.Cl

Isomeric SMILES

C1=CC=C(C=C1)P(=O)(CSC(=N)N)C2=CC=CC=C2.Cl

InChI

InChI=1S/C14H15N2OPS.ClH/c15-14(16)19-11-18(17,12-7-3-1-4-8-12)13-9-5-2-6-10-13;/h1-10H,11H2,(H3,15,16);1H