Vitas-M small molecule compound

2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-[2-(trifluoromethyl)phenyl]hydrazinecarbothioamide

Catalog ID
STK460309
SMILES COc1nn(cc1[N+](=O)[O-])C(C(=O)NNC(=S)Nc1ccccc1C(F)(F)F)C

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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 C15H15F3N6O4S MW 432.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15F3N6O4S/c1-8(23-7-11(24(26)27)13(22-23)28-2)12(25)20-21-14(29)19-10-6-4-3-5-9(10)15(16,17)18/h3-8H,1-2H3,(H,20,25)(H2,19,21,29)
InChIKey
BGQNJIKLXWJBMM-UHFFFAOYSA-N
Synonyms

1(2(3METHOXY4NITROPYRAZOL1YL)PROPANOYLAMINO)3(2(TRIFLUOROMETHYL)PHENYL)THIOUREA
2(2(3methoxy4nitro1Hpyrazol1yl)propanoyl)N(2(trifluoromethyl)phenyl)hydrazinecarbothioamide
2(3METHOXY4NITROPYRAZOLYL)N((THIOXO((2(TRIFLUOROMETHYL)PHENYL)AMINO)METHYL)AMINO)PROPANAMIDE
CC(C(=O)NNC(=S)NC1=CC=CC=C1C(F)(F)F)N2C=C(C(=N2)OC)(N+)(=O)(O)
COc1nn(cc1(N+)(=O)(O))C(C(=O)NNC(=S)Nc1ccccc1C(F)(F)F)C
InChI=1SC15H15F3N6O4Sc18(23711(24(26)27)13(2223)282)12(25)202114(29)191064359(10)15(1617)18h38H12H3(H2025)(H2192129)
MFCD04137316
ZINC000002853120
ZINC000002853121

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Available files

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