2-chloranyl-N-(2-chloroethyl)-N-[dimethylamino(isothiocyanato)phosphoryl]ethanamine

Systemtic Name: 2-chloranyl-N-(2-chloroethyl)-N-[dimethylamino(isothiocyanato)phosphoryl]ethanamine Openeye Name: 2-chloro-N-(2-chloroethyl)-N-[dimethylamino(isothiocyanato)phosphoryl]ethanamine CAS Name: 2-chloro-N-(2-chloroethyl)-N-[dimethylamino(isothiocyanato)phosphoryl]ethanamine IUPAC Name: 2-chloro-N-(2-chloroethyl)-N-[dimethylamino(isothiocyanato)phosphoryl]ethanamine Traditional Name: bis(2-chloroethyl)-[dimethylamino(isothiocyanato)phosphoryl]amine Formula: C7H14Cl2N3OPS MolecularWeight: 290.150321

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)P(=O)(N=C=S)N(CCCl)CCCl

Isomeric SMILES

CN(C)P(=O)(N=C=S)N(CCCl)CCCl

InChI

InChI=1S/C7H14Cl2N3OPS/c1-11(2)14(13,10-7-15)12(5-3-8)6-4-9/h3-6H2,1-2H3