Vitas-M small molecule compound
(4Z)-4-[2-(3-nitrophenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK030252
SMILES NC(=S)N1N=C(/C(=N/Nc2cccc(c2)[N+](=O)[O-])/C1=O)c1ccccc1
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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 C16H12N6O3S MW 368.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6O3S/c17-16(26)21-15(23)14(13(20-21)10-5-2-1-3-6-10)19-18-11-7-4-8-12(9-11)22(24)25/h1-9,18H,(H2,17,26)/b19-14-InChIKey
LZNMCQQQPLIMBW-RGEXLXHISA-NSynonyms
(4Z)4((3NITROPHENYL)HYDRAZINYLIDENE)5OXO3PHENYLPYRAZOLE1CARBOTHIOAMIDE
(4Z)4(2(3NITROPHENYL)HYDRAZINYLIDENE)5OXO3PHENYL45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=CC(=CC=C3)(N+)(=O)(O))C(=S)N
InChI=1SC16H12N6O3Sc1716(26)2115(23)14(13(2021)105213610)19181174812(911)22(24)25h1918H(H21726)b1914
MFCD01418616
NC(=S)N1N=C(C(=NNc2cccc(c2)(N+)(=O)(O))C1=O)c1ccccc1
STK030252
ZINC000013573737
ZINC100512766
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