1-[4,5-bis(diphenylphosphinothioyl)-1,2,3-triazol-2-yl]ethanone

Systemtic Name: 1-[4,5-bis(diphenylphosphinothioyl)-1,2,3-triazol-2-yl]ethanone Openeye Name: 1-[4,5-bis(diphenylphosphinothioyl)triazol-2-yl]ethanone CAS Name: 1-[4,5-bis(diphenylphosphinothioyl)-2-triazolyl]ethanone IUPAC Name: 1-[4,5-bis(diphenylphosphinothioyl)triazol-2-yl]ethanone Traditional Name: 1-[4,5-bis(diphenylthiophosphoryl)triazol-2-yl]ethanone Formula: C28H23N3OP2S2 MolecularWeight: 543.579242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1N=C(C(=N1)P(=S)(C2=CC=CC=C2)C3=CC=CC=C3)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)N1N=C(C(=N1)P(=S)(C2=CC=CC=C2)C3=CC=CC=C3)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H23N3OP2S2/c1-22(32)31-29-27(33(35,23-14-6-2-7-15-23)24-16-8-3-9-17-24)28(30-31)34(36,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21H,1H3