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3-Phenyl-2-[(2,3,4-trimethoxy-6-nitro-benzyl)thio]quinazolin-4-one
SpectraBase Compound ID 6caBzE2uGSM
InChI InChI=1S/C24H21N3O6S/c1-31-20-13-19(27(29)30)17(21(32-2)22(20)33-3)14-34-24-25-18-12-8-7-11-16(18)23(28)26(24)15-9-5-4-6-10-15/h4-13H,14H2,1-3H3
InChIKey PKULMVCMVYVDSK-UHFFFAOYSA-N
Mol Weight 479.51 g/mol
Molecular Formula C24H21N3O6S
Exact Mass 479.115107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk27zqNakTw
Name 3-Phenyl-2-[(2,3,4-trimethoxy-6-nitro-benzyl)thio]quinazolin-4-one
Alternate Name(s) 3-Phenyl-2-[(2,3,4-trimethoxy-6-nitro-phenyl)methylsulfanyl]quinazolin-4-one 3-Phenyl-2-[(2,3,4-trimethoxy-6-nitrophenyl)methylthio]-4-quinazolinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21N3O6S
InChI InChI=1S/C24H21N3O6S/c1-31-20-13-19(27(29)30)17(21(32-2)22(20)33-3)14-34-24-25-18-12-8-7-11-16(18)23(28)26(24)15-9-5-4-6-10-15/h4-13H,14H2,1-3H3
InChIKey PKULMVCMVYVDSK-UHFFFAOYSA-N
Molecular Weight 479.507 g/mol
SMILES c1cc2C(N(C(=Nc2cc1)SCc1c(cc(c(c1OC)OC)OC)N(=O)=O)c1ccccc1)=O
SPLASH splash10-0udi-3790000000-b61f238e13a47e1277ea
Wiley ID 1512459