methyl (2S)-3-bis[(4-chlorophenyl)carbamothioylamino]phosphoryl-2-methyl-propanoate

Systemtic Name: methyl (2S)-3-bis[(4-chlorophenyl)carbamothioylamino]phosphoryl-2-methyl-propanoate Openeye Name: methyl (2S)-3-bis[(4-chlorophenyl)carbamothioylamino]phosphoryl-2-methyl-propanoate CAS Name: (2S)-3-bis[[(4-chloroanilino)-sulfanylidenemethyl]amino]phosphoryl-2-methylpropanoic acid methyl ester IUPAC Name: methyl (2S)-3-bis[(4-chlorophenyl)carbamothioylamino]phosphoryl-2-methylpropanoate Traditional Name: (2S)-3-bis[(4-chlorophenyl)thiocarbamoylamino]phosphoryl-2-methyl-propionic acid methyl ester Formula: C19H21Cl2N4O3PS2 MolecularWeight: 519.404801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CP(=O)(NC(=S)NC1=CC=C(C=C1)Cl)NC(=S)NC2=CC=C(C=C2)Cl)C(=O)OC

Isomeric SMILES

C[C@H](CP(=O)(NC(=S)NC1=CC=C(C=C1)Cl)NC(=S)NC2=CC=C(C=C2)Cl)C(=O)OC

InChI

InChI=1S/C19H21Cl2N4O3PS2/c1-12(17(26)28-2)11-29(27,24-18(30)22-15-7-3-13(20)4-8-15)25-19(31)23-16-9-5-14(21)6-10-16/h3-10,12H,11H2,1-2H3,(H4,22,23,24,25,27,30,31)/t12-/m1/s1