Vitas-M small molecule compound

(2E)-N-(5-{[(2-fluorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide

Catalog ID
STK086755
SMILES O=C(Nc1nnc(s1)CSCc1ccccc1F)/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 C19H16FN3OS2 MW 385.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16FN3OS2/c20-16-9-5-4-8-15(16)12-25-13-18-22-23-19(26-18)21-17(24)11-10-14-6-2-1-3-7-14/h1-11H,12-13H2,(H,21,23,24)/b11-10+
InChIKey
ZYDHWAQZABOEDZ-ZHACJKMWSA-N
Synonyms
310418-54-3
(2E)N(5(((2FLUOROBENZYL)SULFANYL)METHYL)134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
(E)N(5((2FLUOROPHENYL)METHYLSULFANYLMETHYL)134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
310418543
C1=CC=C(C=C1)C=CC(=O)NC2=NN=C(S2)CSCC3=CC=CC=C3F
InChI=1SC19H16FN3OS2c2016954815(16)12251318222319(2618)2117(24)1110146213714h111H1213H2(H212324)b1110+
MFCD01873357
N(5(((2FLUOROBENZYL)SULFANYL)METHYL)134THIADIAZOL2YL)3PHENYLACRYLAMIDE
N(5(((2fluorobenzyl)thio)methyl)134thiadiazol2yl)cinnamamide
O=C(Nc1nnc(s1)CSCc1ccccc1F)C=Cc1ccccc1
STK086755
ZINC000008913812
ZINC08913812
ZINC8913812

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Available files

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