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2-Anilino-3-(triphenylphosphoranylideneamino)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
SpectraBase Compound ID 4oNCZzj32Tc
InChI InChI=1S/C34H29N4OPS/c39-33-31-29-23-13-14-24-30(29)41-32(31)36-34(35-25-15-5-1-6-16-25)38(33)37-40(26-17-7-2-8-18-26,27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-12,15-22H,13-14,23-24H2,(H,35,36)
InChIKey TYRVCZMVRIHCLQ-UHFFFAOYSA-N
Mol Weight 572.7 g/mol
Molecular Formula C34H29N4OPS
Exact Mass 572.17997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Xr4Mx9sGW
Name 2-Anilino-3-(triphenylphosphoranylideneamino)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H29N4OPS
InChI InChI=1S/C34H29N4OPS/c39-33-31-29-23-13-14-24-30(29)41-32(31)36-34(35-25-15-5-1-6-16-25)38(33)37-40(26-17-7-2-8-18-26,27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-12,15-22H,13-14,23-24H2,(H,35,36)
InChIKey TYRVCZMVRIHCLQ-UHFFFAOYSA-N
Molecular Weight 572.667 g/mol
SMILES N(C=1N(C(c2c(sc3c2CCCC3)N1)=O)N=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-08n9-0950050000-f3cdd7e0eeae02c49f37
Source of Spectrum CV-2005-1603-5
Synonyms 2-Anilino-3-(triphenylphosphoranylideneamino)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one 2-Anilino-3-[(triphenyl-$l^{5}-phosphanylidene)amino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one 2-Anilino-3-[(triphenyl-$l^{5}-phosphanylidene)amino]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one
Wiley ID 1611755