Vitas-M small molecule compound

(2E)-2-cyano-3-(3-{[(furan-2-ylmethyl)sulfanyl]methyl}-4-methoxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide

Catalog ID
STK467131
SMILES N#C/C(=C\c1ccc(c(c1)CSCc1ccco1)OC)/C(=O)Nc1nccs1

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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 C20H17N3O3S2 MW 411.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3S2/c1-25-18-5-4-14(10-16(18)12-27-13-17-3-2-7-26-17)9-15(11-21)19(24)23-20-22-6-8-28-20/h2-10H,12-13H2,1H3,(H,22,23,24)/b15-9+
InChIKey
ARKFFAJFHATNEH-OQLLNIDSSA-N
Synonyms

(2E)2cyano3(3(((furan2ylmethyl)sulfanyl)methyl)4methoxyphenyl)N(13thiazol2yl)prop2enamide
(2E)2CYANO3(3((2FURYLMETHYLTHIO)METHYL)4METHOXYPHENYL)N(13THIAZOL2YL)PROP2ENAMIDE
(E)2cyano3(3(furan2ylmethylsulfanylmethyl)4methoxyphenyl)N(13thiazol2yl)prop2enamide
COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC=CS2)CSCC3=CC=CO3
InChI=1SC20H17N3O3S2c125185414(1016(18)122713173272617)915(1121)19(24)232022682820h210H1213H21H3(H222324)b159+
MFCD06118394
N#CC(=Cc1ccc(c(c1)CSCc1ccco1)OC)C(=O)Nc1nccs1
ZINC000017088934
ZINC17088934

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Available files

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