Vitas-M small molecule compound

(2E)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{[5-(4-nitrophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide

Catalog ID
STK867159
SMILES S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)N/N=C/c1ccc(o1)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 C23H20N6O4S MW 476.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N6O4S/c1-15-21(22(30)28(27(15)2)17-6-4-3-5-7-17)25-23(34)26-24-14-19-12-13-20(33-19)16-8-10-18(11-9-16)29(31)32/h3-14H,1-2H3,(H2,25,26,34)/b24-14+
InChIKey
WZBUVKGUABINJT-ZVHZXABRSA-N
Synonyms
290835-54-0
(2E)N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2((5(4nitrophenyl)furan2yl)methylidene)hydrazinecarbothioamide
(E)N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2((5(4nitrophenyl)furan2yl)methylene)hydrazinecarbothioamide
1(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)3((E)(5(4NITROPHENYL)FURAN2YL)METHYLIDENEAMINO)THIOUREA
290835540
4(((((1E)2(5(4NITROPHENYL)(2FURYL))1AZAVINYL)AMINO)THIOXOMETHYL)AMINO)23DIMETHYL1PHENYL3PYRAZOLIN5ONE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NN=CC3=CC=C(O3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H20N6O4Sc11521(22(30)28(27(15)2)176435717)2523(34)26241419121320(3319)1681018(11916)29(31)32h314H12H3(H2252634)b2414+
MFCD02674199
S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)NN=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O)
ZINC000001909097
ZINC06142353
ZINC6142353

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Available files

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