methyl 2-[6-oxidanylidene-2-phenyl-5-(triphenyl-$l^{5}-phosphanylidene)pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: methyl 2-[6-oxidanylidene-2-phenyl-5-(triphenyl-$l^{5}-phosphanylidene)pyrimidin-4-yl]sulfanylethanoate Openeye Name: methyl 2-[6-oxo-2-phenyl-5-(triphenyl-$l^{5}-phosphanylidene)pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[(6-oxo-2-phenyl-5-triphenylphosphoranylidene-4-pyrimidinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[6-oxo-2-phenyl-5-(triphenyl-$l^{5}-phosphanylidene)pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[(6-keto-2-phenyl-5-triphenylphosphoranylidene-pyrimidin-4-yl)thio]acetic acid methyl ester Formula: C31H25N2O3PS MolecularWeight: 536.580561

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=NC(=O)C1=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)CSC1=NC(=NC(=O)C1=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H25N2O3PS/c1-36-27(34)22-38-31-28(30(35)32-29(33-31)23-14-6-2-7-15-23)37(24-16-8-3-9-17-24,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21H,22H2,1H3