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5H-Pyrano[2,3-d]pyrimidine-6-carbonitrile, 4,7-diamino-5-(4-bromophenyl)-2-(methylthio)-
SpectraBase Compound ID G3cXtjXtnJE
InChI InChI=1S/C15H12BrN5OS/c1-23-15-20-12(18)11-10(7-2-4-8(16)5-3-7)9(6-17)13(19)22-14(11)21-15/h2-5,10H,19H2,1H3,(H2,18,20,21)
InChIKey QNILFSFMHJGDNV-UHFFFAOYSA-N
Mol Weight 390.26 g/mol
Molecular Formula C15H12BrN5OS
Exact Mass 388.994594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FX47qqTALcO
Name 5H-Pyrano[2,3-d]pyrimidine-6-carbonitrile, 4,7-diamino-5-(4-bromophenyl)-2-(methylthio)-
Alternate Name(s) 4,7-Diamino-5-(4-bromophenyl)-2-methylsulfanyl-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile 4,7-bis(azanyl)-5-(4-bromophenyl)-2-methylsulfanyl-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12BrN5OS
InChI InChI=1S/C15H12BrN5OS/c1-23-15-20-12(18)11-10(7-2-4-8(16)5-3-7)9(6-17)13(19)22-14(11)21-15/h2-5,10H,19H2,1H3,(H2,18,20,21)
InChIKey QNILFSFMHJGDNV-UHFFFAOYSA-N
Molecular Weight 390.259 g/mol
SMILES Nc1c2c(OC(=C(C2c2ccc(cc2)Br)C#N)N)nc(n1)SC
SPLASH splash10-001i-8790000000-aa72ad38cb8341737a29
Source of Spectrum IY-1-4662-5
Wiley ID 1654608