(E)-[bis(2,6-dimethylphenoxy)phosphinothioylsulfanyl-(cyclohexylamino)methylidene]-cyclohexyl-azanium

Systemtic Name: (E)-[bis(2,6-dimethylphenoxy)phosphinothioylsulfanyl-(cyclohexylamino)methylidene]-cyclohexyl-azanium Openeye Name: (E)-[bis(2,6-dimethylphenoxy)phosphinothioylsulfanyl-(cyclohexylamino)methylene]-cyclohexyl-ammonium CAS Name: (E)-[[bis(2,6-dimethylphenoxy)phosphinothioylthio]-(cyclohexylamino)methylidene]-cyclohexylammonium IUPAC Name: (E)-[bis(2,6-dimethylphenoxy)phosphinothioylsulfanyl-(cyclohexylamino)methylidene]-cyclohexylazanium Traditional Name: (E)-[[bis(2,6-dimethylphenoxy)thiophosphorylthio]-(cyclohexylamino)methylene]-cyclohexyl-ammonium Formula: C29H42N2O2PS2+ MolecularWeight: 545.759741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OP(=S)(OC2=C(C=CC=C2C)C)SC(=[NH+]C3CCCCC3)NC4CCCCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)OP(=S)(OC2=C(C=CC=C2C)C)S/C(=[NH+]/C3CCCCC3)/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)/p+1