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3-Benzyl-5-cyano-1-methyl-6-phenyl-2-thiouracil
SpectraBase Compound ID 6xg0Zt9KsHk
InChI InChI=1S/C19H15N3OS/c1-21-17(15-10-6-3-7-11-15)16(12-20)18(23)22(19(21)24)13-14-8-4-2-5-9-14/h2-11H,13H2,1H3
InChIKey TYDAPLZDIROTBQ-UHFFFAOYSA-N
Mol Weight 333.41 g/mol
Molecular Formula C19H15N3OS
Exact Mass 333.093583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WXCYOtCq0p
Name 3-Benzyl-5-cyano-1-methyl-6-phenyl-2-thiouracil
Alternate Name(s) 3-Benzyl-1-methyl-4-oxo-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N3OS
InChI InChI=1S/C19H15N3OS/c1-21-17(15-10-6-3-7-11-15)16(12-20)18(23)22(19(21)24)13-14-8-4-2-5-9-14/h2-11H,13H2,1H3
InChIKey TYDAPLZDIROTBQ-UHFFFAOYSA-N
Molecular Weight 333.409 g/mol
SMILES C1(N(C(C(=C(N1C)c1ccccc1)C#N)=O)Cc1ccccc1)=S
SPLASH splash10-000x-9218000000-958ca7c6290af70f7c50
Source of Spectrum G-64-1308-4
Wiley ID 749456