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4-(2-Methyl-4-oxoquinazolin-3(4H)-ylamino)-3-phenyl-2-thioxo-2,3-dihydro-thiazole-5-carbonitrile
SpectraBase Compound ID Ef76ec5kOoS
InChI InChI=1S/C19H13N5OS2/c1-12-21-15-10-6-5-9-14(15)18(25)24(12)22-17-16(11-20)27-19(26)23(17)13-7-3-2-4-8-13/h2-10,22H,1H3
InChIKey IZSMYFNZUHWVNH-UHFFFAOYSA-N
Mol Weight 391.47 g/mol
Molecular Formula C19H13N5OS2
Exact Mass 391.056152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEEf4NRfvA4
Name 4-(2-Methyl-4-oxoquinazolin-3(4H)-ylamino)-3-phenyl-2-thioxo-2,3-dihydro-thiazole-5-carbonitrile
Appearance Yellow crystals
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13N5OS2
InChI InChI=1S/C19H13N5OS2/c1-12-21-15-10-6-5-9-14(15)18(25)24(12)22-17-16(11-20)27-19(26)23(17)13-7-3-2-4-8-13/h2-10,22H,1H3
InChIKey IZSMYFNZUHWVNH-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3197
Molecular Weight 391.467 g/mol
SMILES N(N1C(C)=Nc2c(C1=O)cccc2)C=1N(C(SC1C#N)=S)c1ccccc1
SPLASH splash10-00di-1390000000-c24c57d3a349b39f60bc
Source of Spectrum Y-55-1630-5
Wiley ID 1879181