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(4E)-4-[2-(2-methyl-3-nitrophenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide

Catalog ID
STK070532
SMILES NC(=S)N1N=C(/C(=N\Nc2cccc(c2C)[N+](=O)[O-])/C1=O)c1ccc(cc1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H13N7O5S MW 427.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N7O5S/c1-9-12(3-2-4-13(9)24(28)29)19-20-15-14(21-22(16(15)25)17(18)30)10-5-7-11(8-6-10)23(26)27/h2-8,19H,1H3,(H2,18,30)/b20-15+
InChIKey
SUOARXQQPGGKFQ-HMMYKYKNSA-N
Synonyms

(4E)4((2METHYL3NITROPHENYL)HYDRAZINYLIDENE)3(4NITROPHENYL)5OXIDANYLIDENEPYRAZOLE1CARBOTHIOAMIDE
(4E)4((2METHYL3NITROPHENYL)HYDRAZINYLIDENE)3(4NITROPHENYL)5OXO1PYRAZOLECARBOTHIOAMIDE
(4E)4((2METHYL3NITROPHENYL)HYDRAZINYLIDENE)3(4NITROPHENYL)5OXOPYRAZOLE1CARBOTHIOAMIDE
(4E)4(2(2METHYL3NITROPHENYL)HYDRAZINYLIDENE)3(4NITROPHENYL)5OXO45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
(4E)5KETO4((2METHYL3NITROPHENYL)HYDRAZONO)3(4NITROPHENYL)2PYRAZOLINE1CARBOTHIOAMIDE
1(AMINOTHIOXOMETHYL)4(((2METHYL3NITROPHENYL)AMINO)AZAMETHYLENE)3(4NITROPHENYL)12DIAZOLIN5ONE
CC1=C(C=CC=C1(N+)(=O)(O))NN=C2C(=NN(C2=O)C(=S)N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H13N7O5Sc1912(32413(9)24(28)29)19201514(2122(16(15)25)17(18)30)105711(8610)23(26)27h2819H1H3(H21830)b2015+
MFCD01080962
NC(=S)N1N=C(C(=NNc2cccc(c2C)(N+)(=O)(O))C1=O)c1ccc(cc1)(N+)(=O)(O)
STK070532
ZINC000013556681
ZINC101469694

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Available files

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