Vitas-M small molecule compound

(2E)-N-(5-{[2-(9H-fluoren-2-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide

Catalog ID
STK051819
SMILES O=C(Nc1nnc(s1)SCC(=O)c1ccc2c(c1)Cc1c2cccc1)/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 C26H19N3O2S2 MW 469.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O2S2/c30-23(19-11-12-22-20(15-19)14-18-8-4-5-9-21(18)22)16-32-26-29-28-25(33-26)27-24(31)13-10-17-6-2-1-3-7-17/h1-13,15H,14,16H2,(H,27,28,31)/b13-10+
InChIKey
NAYLKRPCDGDOSB-JLHYYAGUSA-N
Synonyms
586392-23-6
(2E)N((2Z)5((2(9HFLUOREN2YL)2OXOETHYL)SULFANYL)134THIADIAZOL2(3H)YLIDENE)3PHENYLPROP2ENAMIDE
(2E)N(5((2(9HFLUOREN2YL)2OXOETHYL)SULFANYL)134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
(E)N(5(2(9HFLUOREN2YL)2OXOETHYL)SULFANYL134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CSC4=NN=C(S4)NC(=O)C=CC5=CC=CC=C5
InChI=1SC26H19N3O2S2c3023(1911122220(1519)1418845921(18)22)163226292825(3326)2724(31)1310176213717h11315H1416H2(H272831)b1310+
MFCD03356341
N(5((2(9Hfluoren2yl)2oxoethyl)thio)134thiadiazol2yl)cinnamamide
O=C(Nc1nnc(s1)SCC(=O)c1ccc2c(c1)Cc1c2cccc1)C=Cc1ccccc1
STK051819
ZINC000009108611
ZINC09108611
ZINC9108611

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Available files

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