bis(2,6-dimethylphenoxy)phosphinothioyl N,N'-dicyclohexylcarbamimidothioate

Systemtic Name: bis(2,6-dimethylphenoxy)phosphinothioyl N,N'-dicyclohexylcarbamimidothioate Openeye Name: 2-bis(2,6-dimethylphenoxy)phosphinothioyl-1,3-dicyclohexyl-isothiourea CAS Name: N,N'-dicyclohexylcarbamimidothioic acid bis(2,6-dimethylphenoxy)phosphinothioyl ester IUPAC Name: bis(2,6-dimethylphenoxy)phosphinothioyl N,N'-dicyclohexylcarbamimidothioate Traditional Name: 2-bis(2,6-dimethylphenoxy)thiophosphoryl-1,3-dicyclohexyl-isothiourea Formula: C29H41N2O2PS2 MolecularWeight: 544.751801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OP(=S)(OC2=C(C=CC=C2C)C)SC(=NC3CCCCC3)NC4CCCCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)OP(=S)(OC2=C(C=CC=C2C)C)SC(=NC3CCCCC3)NC4CCCCC4

InChI

InChI=1S/C29H41N2O2PS2/c1-21-13-11-14-22(2)27(21)32-34(35,33-28-23(3)15-12-16-24(28)4)36-29(30-25-17-7-5-8-18-25)31-26-19-9-6-10-20-26/h11-16,25-26H,5-10,17-20H2,1-4H3,(H,30,31)