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Methyl 1,3-diphenyl-1,3-dihydro-4-oxo-2-thioxo1H-thieno[2,3-d]pyrimidine-6-carboxylate
SpectraBase Compound ID ZXfY9tqS55
InChI InChI=1S/C20H14N2O3S2/c1-25-19(24)16-12-15-17(23)21(13-8-4-2-5-9-13)20(26)22(18(15)27-16)14-10-6-3-7-11-14/h2-12H,1H3
InChIKey BFCVGOZNDSFKIB-UHFFFAOYSA-N
Mol Weight 394.46 g/mol
Molecular Formula C20H14N2O3S2
Exact Mass 394.044585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21bSiUu3D0V
Name Methyl 1,3-diphenyl-1,3-dihydro-4-oxo-2-thioxo1H-thieno[2,3-d]pyrimidine-6-carboxylate
Alternate Name(s) Methyl 4-oxo-1,3-diphenyl-2-thioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14N2O3S2
InChI InChI=1S/C20H14N2O3S2/c1-25-19(24)16-12-15-17(23)21(13-8-4-2-5-9-13)20(26)22(18(15)27-16)14-10-6-3-7-11-14/h2-12H,1H3
InChIKey BFCVGOZNDSFKIB-UHFFFAOYSA-N
Molecular Weight 394.463 g/mol
SMILES C1(N(c2c(C(N1c1ccccc1)=O)cc(s2)C(=O)OC)c1ccccc1)=S
SPLASH splash10-0a59-0094000000-769f4620989b264eb142
Source of Spectrum Y1-35-716-5
Wiley ID 1526776