Vitas-M small molecule compound

1-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(1,1,1,3,3,3-hexafluoropropan-2-yl)urea

Catalog ID
STK537700
SMILES CCSc1nnc(s1)NC(=O)NC(C(F)(F)F)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 C8H8F6N4OS2 MW 354.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H8F6N4OS2/c1-2-20-6-18-17-5(21-6)16-4(19)15-3(7(9,10)11)8(12,13)14/h3H,2H2,1H3,(H2,15,16,17,19)
InChIKey
WIWCUOOKIIZFAQ-UHFFFAOYSA-N
Synonyms

1(5(ethylsulfanyl)134thiadiazol2yl)3(111333hexafluoropropan2yl)urea
1(5(ethylthio)134thiadiazol2yl)3(111333hexafluoropropan2yl)urea
1(5ethylsulfanyl134thiadiazol2yl)3(111333hexafluoropropan2yl)urea
CCSC1=NN=C(S1)NC(=O)NC(C(F)(F)F)C(F)(F)F
InChI=1SC8H8F6N4OS2c1220618175(216)164(19)153(7(910)11)8(1213)14h3H2H21H3(H215161719)
MFCD00575363
ZINC000009357734
ZINC9357734

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Available files

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