[diethoxyphosphinothioylmethylsulfinamoyl-(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]carbamic acid

Systemtic Name: [diethoxyphosphinothioylmethylsulfinamoyl-(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]carbamic acid Openeye Name: [diethoxyphosphinothioylmethylsulfinamoyl-(2,2-dimethyl-3H-benzofuran-7-yl)methyl]carbamic acid CAS Name: [diethoxyphosphinothioylmethylsulfinamoyl-(2,2-dimethyl-3H-benzofuran-7-yl)methyl]carbamic acid IUPAC Name: [diethoxyphosphinothioylmethylsulfinamoyl-(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]carbamic acid Traditional Name: [diethoxythiophosphorylmethylsulfinamoyl-(2,2-dimethylcoumaran-7-yl)methyl]carbamic acid Formula: C17H27N2O6PS2 MolecularWeight: 450.509841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(CNS(=O)C(C1=CC=CC2=C1OC(C2)(C)C)NC(=O)O)OCC

Isomeric SMILES

CCOP(=S)(CNS(=O)C(C1=CC=CC2=C1OC(C2)(C)C)NC(=O)O)OCC

InChI

InChI=1S/C17H27N2O6PS2/c1-5-23-26(27,24-6-2)11-18-28(22)15(19-16(20)21)13-9-7-8-12-10-17(3,4)25-14(12)13/h7-9,15,18-19H,5-6,10-11H2,1-4H3,(H,20,21)