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3-Acetyl-5-(4-methoxyphenyl)-1-phenyl-4-thioxo-4,5-dihydro-1H-1,2,5-triazepin-6,7-dione
SpectraBase Compound ID 7MLCBjyq33n
InChI InChI=1S/C19H15N3O4S/c1-12(23)16-19(27)21(13-8-10-15(26-2)11-9-13)17(24)18(25)22(20-16)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKey OSLUYJHEOAAASZ-UHFFFAOYSA-N
Mol Weight 381.41 g/mol
Molecular Formula C19H15N3O4S
Exact Mass 381.078327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DDt35fEc4L
Name 3-Acetyl-5-(4-methoxyphenyl)-1-phenyl-4-thioxo-4,5-dihydro-1H-1,2,5-triazepin-6,7-dione
Alternate Name(s) 3-Acetyl-5-(4-methoxyphenyl)-1-phenyl-4-thioxo-4,5-dihydro-1H-1,2,5-triazepine-6,7-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N3O4S
InChI InChI=1S/C19H15N3O4S/c1-12(23)16-19(27)21(13-8-10-15(26-2)11-9-13)17(24)18(25)22(20-16)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKey OSLUYJHEOAAASZ-UHFFFAOYSA-N
Molecular Weight 381.406 g/mol
SMILES C1(=NN(C(C(N(C1=S)c1ccc(cc1)OC)=O)=O)c1ccccc1)C(=O)C
SPLASH splash10-004i-7109000000-91a2ad35344614b2f436
Source of Spectrum C5-2003-2562-8
Wiley ID 1616198