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Methanone, (4-chlorophenyl)-[3-[4-methyl-5-(4-methyl-2-thiazonyl)-2-methylthio-3-thienyl]-1-pyrazolyl]-
SpectraBase Compound ID 555ICyX14zw
InChI InChI=1S/C20H16ClN3OS3/c1-11-10-27-18(22-11)17-12(2)16(20(26-3)28-17)15-8-9-24(23-15)19(25)13-4-6-14(21)7-5-13/h4-10H,1-3H3
InChIKey SRWITWSTQJRUOE-UHFFFAOYSA-N
Mol Weight 446.0 g/mol
Molecular Formula C20H16ClN3OS3
Exact Mass 445.014403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xOzYPzxdo0
Name Methanone, (4-chlorophenyl)-[3-[4-methyl-5-(4-methyl-2-thiazonyl)-2-methylthio-3-thienyl]-1-pyrazolyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16ClN3OS3
InChI InChI=1S/C20H16ClN3OS3/c1-11-10-27-18(22-11)17-12(2)16(20(26-3)28-17)15-8-9-24(23-15)19(25)13-4-6-14(21)7-5-13/h4-10H,1-3H3
InChIKey SRWITWSTQJRUOE-UHFFFAOYSA-N
Molecular Weight 446.001 g/mol
SMILES c1(c(sc(c1C)-c1nc(C)cs1)SC)-c1n[n](C(c2ccc(cc2)Cl)=O)cc1
SPLASH splash10-01p9-2910200000-95e30913795405d1a111
Source of Spectrum AD-0-2532-0
Synonyms (4-chlorophenyl)-[3-[4-methyl-2-methylsulfanyl-5-(4-methyl-1,3-thiazol-2-yl)thiophen-3-yl]pyrazol-1-yl]methanone (4-chlorophenyl)-[3-[4-methyl-2-methylsulfanyl-5-(4-methylthiazol-2-yl)-3-thienyl]pyrazol-1-yl]methanone (4-chlorophenyl)-[3-[4-methyl-5-(4-methyl-2-thiazolyl)-2-(methylthio)-3-thiophenyl]-1-pyrazolyl]methanone (4-chlorophenyl)-[3-[4-methyl-5-(4-methylthiazol-2-yl)-2-(methylthio)-3-thienyl]pyrazol-1-yl]methanone
Wiley ID 1429139