(2-methylphenyl) (2-methyl-6-propan-2-yl-phenyl) [4-(3-sulfanylidene-1,2-dithiol-4-yl)phenyl] phosphate

Systemtic Name: (2-methylphenyl) (2-methyl-6-propan-2-yl-phenyl) [4-(3-sulfanylidene-1,2-dithiol-4-yl)phenyl] phosphate Openeye Name: (2-isopropyl-6-methyl-phenyl) o-tolyl [4-(3-thioxodithiol-4-yl)phenyl] phosphate CAS Name: phosphoric acid (2-methylphenyl) (2-methyl-6-propan-2-ylphenyl) [4-(3-sulfanylidene-4-dithiolyl)phenyl] ester IUPAC Name: (2-methylphenyl) (2-methyl-6-propan-2-ylphenyl) [4-(3-sulfanylidenedithiol-4-yl)phenyl] phosphate Traditional Name: phosphoric acid (2-isopropyl-6-methyl-phenyl) o-tolyl [4-(3-thioxodithiol-4-yl)phenyl] ester Formula: C26H25O4PS3 MolecularWeight: 528.643061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)OP(=O)(OC2=CC=C(C=C2)C3=CSSC3=S)OC4=CC=CC=C4C

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)OP(=O)(OC2=CC=C(C=C2)C3=CSSC3=S)OC4=CC=CC=C4C

InChI

InChI=1S/C26H25O4PS3/c1-17(2)22-10-7-9-19(4)25(22)30-31(27,29-24-11-6-5-8-18(24)3)28-21-14-12-20(13-15-21)23-16-33-34-26(23)32/h5-17H,1-4H3