Vitas-M small molecule compound
N-methyl-5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK845939
SMILES CNC(=S)N1N=C(CC1c1cccc(c1)[N+](=O)[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 C17H16N4O2S MW 340.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O2S/c1-18-17(24)20-16(13-8-5-9-14(10-13)21(22)23)11-15(19-20)12-6-3-2-4-7-12/h2-10,16H,11H2,1H3,(H,18,24)InChIKey
VKVLVILAGKDFPX-UHFFFAOYSA-NSynonyms
383902-62-3383902623
CNC(=S)N1C(CC(=N1)C2=CC=CC=C2)C3=CC(=CC=C3)(N+)(=O)(O)
CNC(=S)N1N=C(CC1c1cccc(c1)(N+)(=O)(O))c1ccccc1
InChI=1SC17H16N4O2Sc11817(24)2016(1385914(1013)21(22)23)1115(1920)126324712h21016H11H21H3(H1824)
MFCD03283928
NMETHYL3(3NITROPHENYL)5PHENYL34DIHYDROPYRAZOLE2CARBOTHIOAMIDE
Nmethyl5(3nitrophenyl)3phenyl45dihydro1Hpyrazole1carbothioamide
ZINC000000547356
ZINC000000547357
ZINC00547356
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