Vitas-M small molecule compound
ethyl 2-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
Catalog ID
STL002838
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccs2)/C#N)sc(c1C)C(=O)Nc1ccccc1C
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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 C26H22N4O3S3 MW 534.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O3S3/c1-4-33-26(32)21-16(3)22(23(31)29-18-9-6-5-8-15(18)2)36-25(21)28-13-17(12-27)24-30-19(14-35-24)20-10-7-11-34-20/h5-11,13-14,28H,4H2,1-3H3,(H,29,31)/b17-13-InChIKey
YNCSWCMCUVYQFZ-LGMDPLHJSA-NSynonyms
(E)ethyl2((2cyano2(4(thiophen2yl)thiazol2yl)vinyl)amino)4methyl5(otolylcarbamoyl)thiophene3carboxylate
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC=C(C#N)C3=NC(=CS3)C4=CC=CS4
CCOC(=O)c1c(NC=C(c2scc(n2)c2cccs2)C#N)sc(c1C)C(=O)Nc1ccccc1C
ethyl2(((Z)2cyano2(4(thiophen2yl)13thiazol2yl)ethenyl)amino)4methyl5((2methylphenyl)carbamoyl)thiophene3carboxylate
ETHYL2(((Z)2CYANO2(4THIOPHEN2YL13THIAZOL2YL)ETHENYL)AMINO)4METHYL5((2METHYLPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC26H22N4O3S3c143326(32)2116(3)22(23(31)2918965815(18)2)3625(21)281317(1227)243019(143524)20107113420h511131428H4H213H3(H2931)b1713
MFCD18185360
ZINC000002385084
ZINC2385084
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