Vitas-M small molecule compound
(2E)-3-(4-fluorophenyl)-N-({2-[(4-methyl-3-phenyl-1H-pyrazol-5-yl)carbonyl]hydrazinyl}carbonothioyl)prop-2-enamide
Catalog ID
STK328941
SMILES S=C(NC(=O)/C=C/c1ccc(cc1)F)NNC(=O)c1[nH]nc(c1C)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 C21H18FN5O2S MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN5O2S/c1-13-18(15-5-3-2-4-6-15)24-25-19(13)20(29)26-27-21(30)23-17(28)12-9-14-7-10-16(22)11-8-14/h2-12H,1H3,(H,24,25)(H,26,29)(H2,23,27,28,30)/b12-9+InChIKey
CNYKUTIQDCMOKJ-FMIVXFBMSA-NSynonyms
(2E)3(4fluorophenyl)N((2((4methyl3phenyl1Hpyrazol5yl)carbonyl)hydrazinyl)carbonothioyl)prop2enamide
(E)3(4fluorophenyl)N(((4methyl3phenyl1Hpyrazole5carbonyl)amino)carbamothioyl)prop2enamide
CC1=C(NN=C1C2=CC=CC=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=C(C=C3)F
InChI=1SC21H18FN5O2Sc11318(155324615)242519(13)20(29)262721(30)2317(28)1291471016(22)11814h212H1H3(H2425)(H2629)(H223272830)b129+
MFCD09961720
S=C(NC(=O)C=Cc1ccc(cc1)F)NNC(=O)c1(nH)nc(c1C)c1ccccc1
ZINC000018191286
ZINC18191286
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