phenyl (3-propan-2-ylphenyl) [4-(3-sulfanylidene-1,2-dithiol-4-yl)phenyl] phosphate

Systemtic Name: phenyl (3-propan-2-ylphenyl) [4-(3-sulfanylidene-1,2-dithiol-4-yl)phenyl] phosphate Openeye Name: (3-isopropylphenyl) phenyl [4-(3-thioxodithiol-4-yl)phenyl] phosphate CAS Name: phosphoric acid phenyl (3-propan-2-ylphenyl) [4-(3-sulfanylidene-4-dithiolyl)phenyl] ester IUPAC Name: phenyl (3-propan-2-ylphenyl) [4-(3-sulfanylidenedithiol-4-yl)phenyl] phosphate Traditional Name: phosphoric acid m-cumenyl phenyl [4-(3-thioxodithiol-4-yl)phenyl] ester Formula: C24H21O4PS3 MolecularWeight: 500.589901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=C(C=C3)C4=CSSC4=S

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=C(C=C3)C4=CSSC4=S

InChI

InChI=1S/C24H21O4PS3/c1-17(2)19-7-6-10-22(15-19)28-29(25,26-20-8-4-3-5-9-20)27-21-13-11-18(12-14-21)23-16-31-32-24(23)30/h3-17H,1-2H3