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3-(5,6-Dimethyl-2,4-dioxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)propanenitrile
SpectraBase Compound ID 3gEM4o52X6O
InChI InChI=1S/C17H15N3O2S/c1-11-12(2)23-16-14(11)15(21)20(13-7-4-3-5-8-13)17(22)19(16)10-6-9-18/h3-5,7-8H,6,10H2,1-2H3
InChIKey UIMNVKVHYIMJMV-UHFFFAOYSA-N
Mol Weight 325.39 g/mol
Molecular Formula C17H15N3O2S
Exact Mass 325.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzY3me9ofOC
Name 3-(5,6-Dimethyl-2,4-dioxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)propanenitrile
Alternate Name(s) 3-(2,4-diketo-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-1-yl)propionitrile 3-(5,6-dimethyl-2,4-dioxo-3-phenyl-1-thieno[2,3-d]pyrimidinyl)propanenitrile 3-(5,6-dimethyl-2,4-dioxo-3-phenyl-thieno[2,3-d]pyrimidin-1-yl)propanenitrile 3-[5,6-dimethyl-2,4-bis(oxidanylidene)-3-phenyl-thieno[2,3-d]pyrimidin-1-yl]propanenitrile Propionitrile, 3-(5,6-dimethyl-2,4-dioxo-3-phenyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-1-yl)-
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Formula C17H15N3O2S
InChI InChI=1S/C17H15N3O2S/c1-11-12(2)23-16-14(11)15(21)20(13-7-4-3-5-8-13)17(22)19(16)10-6-9-18/h3-5,7-8H,6,10H2,1-2H3
InChIKey UIMNVKVHYIMJMV-UHFFFAOYSA-N
Molecular Weight 325.386 g/mol
SMILES c12c(C(=O)N(C(N2CCC#N)=O)c2ccccc2)c(C)c(s1)C
SPLASH splash10-016r-5923000000-b582163554b786af86d8
Wiley ID 1441825