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3-(4"-Bromophenyl)-5-(3'-pyridyl)-1-(thiocarbamoyl)-2-pyrazoline
SpectraBase Compound ID GnXCmNDHR3F
InChI InChI=1S/C15H13BrN4S/c16-12-5-3-10(4-6-12)13-8-14(20(19-13)15(17)21)11-2-1-7-18-9-11/h1-7,9,14H,8H2,(H2,17,21)
InChIKey KMVDVHFLTXDPHD-UHFFFAOYSA-N
Mol Weight 361.26 g/mol
Molecular Formula C15H13BrN4S
Exact Mass 360.004431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DdL0N1cK7rM
Name 3-(4"-Bromophenyl)-5-(3'-pyridyl)-1-(thiocarbamoyl)-2-pyrazoline
Alternate Name(s) 3-(4'-Bromophenyl)-5-(3-pyridinyl)-1-thicarbamoyl-2-pyrazoline 3-(4-bromophenyl)-5-(3-pyridinyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide 3-(4-bromophenyl)-5-(pyridin-3-yl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
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Formula C15H13BrN4S
InChI InChI=1S/C15H13BrN4S/c16-12-5-3-10(4-6-12)13-8-14(20(19-13)15(17)21)11-2-1-7-18-9-11/h1-7,9,14H,8H2,(H2,17,21)
InChIKey KMVDVHFLTXDPHD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200300810
Molecular Weight 361.261 g/mol
SMILES NC(=S)N1N=C(CC1c1cnccc1)c1ccc(cc1)Br
SPLASH splash10-0fbc-0915000000-9bc3b132d2f1b883016f
Source of Spectrum APP-337-33-7d
Wiley ID 1770752