4,6-bis(diphenylphosphoryl)-2-methylsulfanyl-pyrimidine

Systemtic Name: 4,6-bis(diphenylphosphoryl)-2-methylsulfanyl-pyrimidine Openeye Name: 4,6-bis(diphenylphosphoryl)-2-methylsulfanyl-pyrimidine CAS Name: 4,6-bis(diphenylphosphoryl)-2-(methylthio)pyrimidine IUPAC Name: 4,6-bis(diphenylphosphoryl)-2-methylsulfanylpyrimidine Traditional Name: 4,6-bis(diphenylphosphoryl)-2-(methylthio)pyrimidine Formula: C29H24N2O2P2S MolecularWeight: 526.525582

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)P(=O)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CSC1=NC(=CC(=N1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)P(=O)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H24N2O2P2S/c1-36-29-30-27(34(32,23-14-6-2-7-15-23)24-16-8-3-9-17-24)22-28(31-29)35(33,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-22H,1H3