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2-(Methylthio)-3-[1'-(p-nitrophenyl)-5'-phenyl-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene
SpectraBase Compound ID JdZnpgqQHrs
InChI InChI=1S/C21H19N3O2S2/c1-14-12-18(21(27-2)28-14)19-13-20(15-6-4-3-5-7-15)23(22-19)16-8-10-17(11-9-16)24(25)26/h3-12,20H,13H2,1-2H3
InChIKey RBTDCMYYLBLEQB-UHFFFAOYSA-N
Mol Weight 409.52 g/mol
Molecular Formula C21H19N3O2S2
Exact Mass 409.091869 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9v07iDfVNS5
Name 2-(Methylthio)-3-[1'-(p-nitrophenyl)-5'-phenyl-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene
Alternate Name(s) 2-(Methylthio)-3-[1'-(p-nitrophenyl)-3'-phenyl-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene 3-[5-methyl-2-(methylsulfanyl)-3-thienyl]-1-(4-nitrophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole 5-Methyl-3-[1'-(p-nitrophenyl)-5'-phenyl-4',5'-dihydropyrazol-3'-yl]-2-(methylthio)thiophene Methyl 5-methyl-3-[1-(4-nitrophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl]-2-thienyl sulfide
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Formula C21H19N3O2S2
InChI InChI=1S/C21H19N3O2S2/c1-14-12-18(21(27-2)28-14)19-13-20(15-6-4-3-5-7-15)23(22-19)16-8-10-17(11-9-16)24(25)26/h3-12,20H,13H2,1-2H3
InChIKey RBTDCMYYLBLEQB-UHFFFAOYSA-N
Molecular Weight 409.522 g/mol
SMILES c1(C2=NN(c3ccc(N(=O)=O)cc3)C(C2)c2ccccc2)c(sc(c1)C)SC
SPLASH splash10-0cf3-0209600000-bdea8226bce001d7c1e6
Source of Spectrum F9-1994-115-6
Wiley ID 1566849