Vitas-M small molecule compound

1-methyl-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide

Catalog ID
STK316629
SMILES O=C(c1cc(nn1C)C(F)(F)F)Nc1ccc(cc1)S(=O)(=O)N1CCCC1

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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 C16H17F3N4O3S MW 402.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17F3N4O3S/c1-22-13(10-14(21-22)16(17,18)19)15(24)20-11-4-6-12(7-5-11)27(25,26)23-8-2-3-9-23/h4-7,10H,2-3,8-9H2,1H3,(H,20,24)
InChIKey
GEBLSGPNGXVEHV-UHFFFAOYSA-N
Synonyms
515120-72-6
1methylN(4(pyrrolidin1ylsulfonyl)phenyl)3(trifluoromethyl)1Hpyrazole5carboxamide
2METHYLN(4PYRROLIDIN1YLSULFONYLPHENYL)5(TRIFLUOROMETHYL)PYRAZOLE3CARBOXAMIDE
515120726
CN1C(=CC(=N1)C(F)(F)F)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3
InChI=1SC16H17F3N4O3Sc12213(1014(2122)16(1718)19)15(24)20114612(7511)27(2526)23823923h4710H2389H21H3(H2024)
MFCD03758070
ZINC000002762733
ZINC02762733
ZINC2762733

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.