Vitas-M small molecule compound

(2E)-3-[4-(benzyloxy)-3-methoxyphenyl]-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide

Catalog ID
STK326129
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCc1ccccc1)/C(=O)NCc1cccs1

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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 C23H20N2O3S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O3S/c1-27-22-13-18(9-10-21(22)28-16-17-6-3-2-4-7-17)12-19(14-24)23(26)25-15-20-8-5-11-29-20/h2-13H,15-16H2,1H3,(H,25,26)/b19-12+
InChIKey
DMRIQWYHHLEHRO-XDHOZWIPSA-N
Synonyms

(2E)3(4(BENZYLOXY)3METHOXYPHENYL)2CYANON(THIOPHEN2YLMETHYL)PROP2ENAMIDE
(E)2cyano3(3methoxy4phenylmethoxyphenyl)N(thiophen2ylmethyl)prop2enamide
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2=CC=CS2)OCC3=CC=CC=C3
InChI=1SC23H20N2O3Sc127221318(91021(22)2816176324717)1219(1424)23(26)25152085112920h213H1516H21H3(H2526)b1912+
MFCD02195453
N#CC(=Cc1ccc(c(c1)OC)OCc1ccccc1)C(=O)NCc1cccs1
ZINC000006181451
ZINC06181451
ZINC6181451

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Available files

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