Vitas-M small molecule compound
1-[(2Z)-5-[4-(ethylsulfonyl)butyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-[3-(trifluoromethyl)phenyl]urea
Catalog ID
STK854382
SMILES CCS(=O)(=O)CCCCc1n[nH]/c(=N/C(=O)Nc2cccc(c2)C(F)(F)F)/s1
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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 C16H19F3N4O3S2 MW 436.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19F3N4O3S2/c1-2-28(25,26)9-4-3-8-13-22-23-15(27-13)21-14(24)20-12-7-5-6-11(10-12)16(17,18)19/h5-7,10H,2-4,8-9H2,1H3,(H2,20,21,23,24)InChIKey
ALAGDEJOKPYIQW-UHFFFAOYSA-NSynonyms
371204-23-81((2Z)5(4(ethylsulfonyl)butyl)134thiadiazol2(3H)ylidene)3(3(trifluoromethyl)phenyl)urea
1(5(4ETHYLSULFONYLBUTYL)134THIADIAZOL2YL)3(3(TRIFLUOROMETHYL)PHENYL)UREA
371204238
CCS(=O)(=O)CCCCC1=NN=C(S1)NC(=O)NC2=CC=CC(=C2)C(F)(F)F
CCS(=O)(=O)CCCCc1n(nH)c(=NC(=O)Nc2cccc(c2)C(F)(F)F)s1
InChI=1SC16H19F3N4O3S2c1228(2526)943813222315(2713)2114(24)201275611(1012)16(1718)19h5710H2489H21H3(H220212324)
MFCD08736627
ZINC000008767609
ZINC08767609
ZINC8767609
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