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3-[2-[[2-(4-nitrophenyl)-1,3-thiazol-4-yl]methyl]-1,3-thiazol-4-yl]chromen-2-one
SpectraBase Compound ID 7BFaQ4gKEPe
InChI InChI=1S/C22H13N3O4S2/c26-22-17(9-14-3-1-2-4-19(14)29-22)18-12-30-20(24-18)10-15-11-31-21(23-15)13-5-7-16(8-6-13)25(27)28/h1-9,11-12H,10H2
InChIKey FWMRZTIHQZSWBB-UHFFFAOYSA-N
Mol Weight 447.48 g/mol
Molecular Formula C22H13N3O4S2
Exact Mass 447.034748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYGn9HGeape
Name 3-[2-[[2-(4-nitrophenyl)-1,3-thiazol-4-yl]methyl]-1,3-thiazol-4-yl]chromen-2-one
Alternate Name(s) 3-[2-[[2-(4-nitrophenyl)-4-thiazolyl]methyl]-4-thiazolyl]-1-benzopyran-2-one 3-[2-[[2-(4-nitrophenyl)thiazol-4-yl]methyl]thiazol-4-yl]chromen-2-one 3-[2-[[2-(4-nitrophenyl)thiazol-4-yl]methyl]thiazol-4-yl]coumarin
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Formula C22H13N3O4S2
InChI InChI=1S/C22H13N3O4S2/c26-22-17(9-14-3-1-2-4-19(14)29-22)18-12-30-20(24-18)10-15-11-31-21(23-15)13-5-7-16(8-6-13)25(27)28/h1-9,11-12H,10H2
InChIKey FWMRZTIHQZSWBB-UHFFFAOYSA-N
Molecular Weight 447.483 g/mol
SMILES C=1(c2nc(Cc3nc(-c4ccc(N(=O)=O)cc4)sc3)sc2)C(Oc2c(C1)cccc2)=O
SPLASH splash10-0002-6910200000-3665f53092df42a95831
Wiley ID 1457929