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3-(2-Chlorophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]quinazolin-4-one
SpectraBase Compound ID 550QYhoJvXx
InChI InChI=1S/C18H13ClN4OS2/c1-11-21-22-18(26-11)25-10-16-20-14-8-4-2-6-12(14)17(24)23(16)15-9-5-3-7-13(15)19/h2-9H,10H2,1H3
InChIKey YQOMBGAYPHJRFC-UHFFFAOYSA-N
Mol Weight 400.9 g/mol
Molecular Formula C18H13ClN4OS2
Exact Mass 400.021931 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATo8wx2ZHnB
Name 3-(2-Chlorophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]quinazolin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13ClN4OS2
InChI InChI=1S/C18H13ClN4OS2/c1-11-21-22-18(26-11)25-10-16-20-14-8-4-2-6-12(14)17(24)23(16)15-9-5-3-7-13(15)19/h2-9H,10H2,1H3
InChIKey YQOMBGAYPHJRFC-UHFFFAOYSA-N
Molecular Weight 400.902 g/mol
SMILES c1ccc(N2C(c3ccccc3N=C2CSc2sc(C)nn2)=O)c(Cl)c1
SPLASH splash10-0159-7694000000-3c1f79e6cdce72875d5e
Synonyms 3-(2-Chlorophenyl)-2-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-4-quinazolinone 3-(2-Chlorophenyl)-2-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]quinazolin-4-one
Wiley ID 1437074