Vitas-M small molecule compound

ethyl 4-({4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}sulfonyl)benzoate

Catalog ID
STK776390
SMILES CCOC(=O)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ncc(cc1Cl)C(F)(F)F

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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 C19H19ClF3N3O4S MW 477.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClF3N3O4S/c1-2-30-18(27)13-3-5-15(6-4-13)31(28,29)26-9-7-25(8-10-26)17-16(20)11-14(12-24-17)19(21,22)23/h3-6,11-12H,2,7-10H2,1H3
InChIKey
GGZQJDQJXIHDKH-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl
ethyl4((4(3chloro5(trifluoromethyl)pyridin2yl)piperazin1yl)sulfonyl)benzoate
ETHYL4(4(3CHLORO5(TRIFLUOROMETHYL)PYRIDIN2YL)PIPERAZIN1YL)SULFONYLBENZOATE
InChI=1SC19H19ClF3N3O4Sc123018(27)133515(6413)31(2829)269725(81026)1716(20)1114(122417)19(2122)23h361112H2710H21H3
MFCD05258956
ZINC000019858064
ZINC19858064

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Available files

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