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2-(4-Chlorophenyl)amino-3-(triphenylphosphoranylidene)amino-benzo[4,5]thieno[3,2-d]pyrimidin-4(3H)-one
SpectraBase Compound ID LweXa3oBxVB
InChI InChI=1S/C34H24ClN4OPS/c35-24-20-22-25(23-21-24)36-34-37-31-29-18-10-11-19-30(29)42-32(31)33(40)39(34)38-41(26-12-4-1-5-13-26,27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-23H,(H,36,37)
InChIKey YGMCIQNFQLDBRF-UHFFFAOYSA-N
Mol Weight 603.1 g/mol
Molecular Formula C34H24ClN4OPS
Exact Mass 602.109697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hx8H5OStwKg
Name 2-(4-Chlorophenyl)amino-3-(triphenylphosphoranylidene)amino-benzo[4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Alternate Name(s) 2-(4-Chloroanilino)-3-(triphenylphosphoranylideneamino)-[1]benzothiolo[3,2-d]pyrimidin-4-one 2-(4-Chloroanilino)-3-[(triphenyl-$l^{5}-phosphanylidene)amino]-[1]benzothiolo[3,2-d]pyrimidin-4-one 2-(4-Chloroanilino)-3-[(triphenyl-$l^{5}-phosphanylidene)amino]benzothiopheno[3,2-d]pyrimidin-4-one 2-[(4-chlorophenyl)amino]-3-[(triphenyl-$l^{5}-phosphanylidene)amino]-[1]benzothiolo[3,2-d]pyrimidin-4-one
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Formula C34H24ClN4OPS
InChI InChI=1S/C34H24ClN4OPS/c35-24-20-22-25(23-21-24)36-34-37-31-29-18-10-11-19-30(29)42-32(31)33(40)39(34)38-41(26-12-4-1-5-13-26,27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-23H,(H,36,37)
InChIKey YGMCIQNFQLDBRF-UHFFFAOYSA-N
Molecular Weight 603.080 g/mol
SMILES N(C=1N(C(c2c(c3ccccc3s2)N1)=O)N=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(cc1)Cl
SPLASH splash10-0ufs-2651009000-3b0b601fad06fe5a320a
Source of Spectrum Y-46-906-5b
Wiley ID 1666863