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5-Amino-3-(t-butyl)-1-[3'-phthalimido-1'-(p-tosylimino)propyl]-1H-pyrazole

View entire compound with spectra: 1 MS (GC)

5-Amino-3-(t-butyl)-1-[3'-phthalimido-1'-(p-tosylimino)propyl]-1H-pyrazole
SpectraBase Compound ID 7IOifxTfJOA
InChI InChI=1S/C25H27N5O5S/c1-16-9-11-17(12-10-16)36(33,34)35-28-22(30-21(26)15-20(27-30)25(2,3)4)13-14-29-23(31)18-7-5-6-8-19(18)24(29)32/h5-12,15H,13-14,26H2,1-4H3/b28-22-
InChIKey AVWMAMYRLHBFDV-SLMZUGIISA-N
Mol Weight 509.58 g/mol
Molecular Formula C25H27N5O5S
Exact Mass 509.17329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34h4WLGTwm
Name 5-Amino-3-(t-butyl)-1-[3'-phthalimido-1'-(p-tosylimino)propyl]-1H-pyrazole
Alternate Name(s) 2-[(3Z)-3-(5-amino-3-tert-butyl-1H-pyrazol-1-yl)-3-({[(4-methylphenyl)sulfonyl]oxy}imino)propyl]-1H-isoindole-1,3(2H)-dione 4-Methylbenzenesulfonic acid[(Z)-[1-(5-amino-3-tert-butyl-1-pyrazolyl)-3-(1,3-dioxo-2-isoindolyl)propylidene]amino]ester 4-Methylbenzenesulfonic acid[(Z)-[1-(5-amino-3-tert-butyl-pyrazol-1-yl)-3-phthalimido-propylidene]amino]ester [(Z)-[1-(5-amino-3-tert-butyl-pyrazol-1-yl)-3-(1,3-dioxoisoindolin-2-yl)propylidene]amino]4-methylbenzenesulfonate [(Z)-[1-(5-amino-3-tert-butylpyrazol-1-yl)-3-(1,3-dioxoisoindol-2-yl)propylidene]amino]4-methylbenzenesulfonate [(Z)-[1-(5-azanyl-3-tert-butyl-pyrazol-1-yl)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylidene]amino]4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid [(Z)-[1-(5-amino-3-tert-butyl-1-pyrazolyl)-3-(1,3-dioxo-2-isoindolyl)propylidene]amino] ester [(Z)-[1-(5-amino-3-tert-butylpyrazol-1-yl)-3-(1,3-dioxoisoindol-2-yl)propylidene]amino] 4-methylbenzenesulfonate [(Z)-[1-(5-amino-3-tert-butyl-pyrazol-1-yl)-3-(1,3-dioxoisoindolin-2-yl)propylidene]amino] 4-methylbenzenesulfonate [(Z)-[1-(5-azanyl-3-tert-butyl-pyrazol-1-yl)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]propylidene]amino] 4-methylbenzenesulfonate
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Formula C25H27N5O5S
InChI InChI=1S/C25H27N5O5S/c1-16-9-11-17(12-10-16)36(33,34)35-28-22(30-21(26)15-20(27-30)25(2,3)4)13-14-29-23(31)18-7-5-6-8-19(18)24(29)32/h5-12,15H,13-14,26H2,1-4H3/b28-22-
InChIKey AVWMAMYRLHBFDV-SLMZUGIISA-N
Molecular Weight 509.581 g/mol
SMILES Nc1[n](\C(CCN2C(c3ccccc3C2=O)=O)=N\OS(c2ccc(cc2)C)(=O)=O)nc(C(C)(C)C)c1
SPLASH splash10-01ta-5900000000-9fe79980764ea59b699c
Source of Spectrum U-1994-1040-4
Wiley ID 766145