Vitas-M small molecule compound

(2E)-N-{5-[(2-oxo-2-{[2-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylprop-2-enamide

Catalog ID
STK016657
SMILES O=C(Nc1nnc(s1)SCC(=O)Nc1ccccc1C(F)(F)F)/C=C/c1ccccc1

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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 C20H15F3N4O2S2 MW 464.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N4O2S2/c21-20(22,23)14-8-4-5-9-15(14)24-17(29)12-30-19-27-26-18(31-19)25-16(28)11-10-13-6-2-1-3-7-13/h1-11H,12H2,(H,24,29)(H,25,26,28)/b11-10+
InChIKey
BAJQEWBTLBYVTQ-ZHACJKMWSA-N
Synonyms
392296-90-1
(2E)N((2Z)5((2OXO2((2(TRIFLUOROMETHYL)PHENYL)AMINO)ETHYL)SULFANYL)134THIADIAZOL2(3H)YLIDENE)3PHENYLPROP2ENAMIDE
(2E)N(5((2OXO2((2(TRIFLUOROMETHYL)PHENYL)AMINO)ETHYL)SULFANYL)134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
(E)N(5(2OXO2(2(TRIFLUOROMETHYL)ANILINO)ETHYL)SULFANYL134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
C1=CC=C(C=C1)C=CC(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3C(F)(F)F
InChI=1SC20H15F3N4O2S2c2120(2223)14845915(14)2417(29)123019272618(3119)2516(28)1110136213713h111H12H2(H2429)(H252628)b1110+
MFCD03356390
N(5((2oxo2((2(trifluoromethyl)phenyl)amino)ethyl)thio)134thiadiazol2yl)cinnamamide
O=C(Nc1nnc(s1)SCC(=O)Nc1ccccc1C(F)(F)F)C=Cc1ccccc1
STK016657
ZINC000008969727
ZINC08969727
ZINC8969727

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Available files

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