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4-AMINO-3-(PARA-METHYL-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-METHYL-PHENYL-4',5'-DIHYDRO-1'H-PYRAZOL-3'-YL-SULFONYL-METHYL)-1,2,4-TRIAZOLE

View entire compound with spectra: 1 NMR

4-AMINO-3-(PARA-METHYL-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-METHYL-PHENYL-4',5'-DIHYDRO-1'H-PYRAZOL-3'-YL-SULFONYL-METHYL)-1,2,4-TRIAZOLE
SpectraBase Compound ID EOUjo8qnQUY
InChI InChI=1S/C21H25N7O4S2/c1-14-3-7-16(8-4-14)18-11-23-26-21(18)33(29,30)12-19-24-25-20(28(19)22)13-34(31,32)27-17-9-5-15(2)6-10-17/h3-10,18,23,27H,11-13,22H2,1-2H3/t18-/m0/s1
InChIKey ITZJTVDPBMNEBA-SFHVURJKSA-N
Mol Weight 503.6 g/mol
Molecular Formula C21H25N7O4S2
Exact Mass 503.140945 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4vj0wNNOwnt
Name 4-AMINO-3-(PARA-METHYL-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-METHYL-PHENYL-4',5'-DIHYDRO-1'H-PYRAZOL-3'-YL-SULFONYL-METHYL)-1,2,4-TRIAZOLE
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H25N7O4S2
InChI InChI=1S/C21H25N7O4S2/c1-14-3-7-16(8-4-14)18-11-23-26-21(18)33(29,30)12-19-24-25-20(28(19)22)13-34(31,32)27-17-9-5-15(2)6-10-17/h3-10,18,23,27H,11-13,22H2,1-2H3/t18-/m0/s1
InChIKey ITZJTVDPBMNEBA-SFHVURJKSA-N
Literature Reference Author A.PADMAJA,A.MURALIKRISHNA,C.RAJASEKHAR,V.PADMAVATHI
Literature Reference Citation CHEM.PHARM.BULL.,59,1509(2011)
Literature Reference DOI 10.1248/cpb.59.1509
Molecular Weight 503.594 g/mol
Source File Reference UWIR3767