Vitas-M small molecule compound
4-ethyl 2-methyl 5-({(Z)-2-cyano-2-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK803905
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(cc2)C2CCCCC2)/C#N)sc(c1C)C(=O)OC
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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 C28H29N3O4S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S2/c1-4-35-27(32)23-17(2)24(28(33)34-3)37-26(23)30-15-21(14-29)25-31-22(16-36-25)20-12-10-19(11-13-20)18-8-6-5-7-9-18/h10-13,15-16,18,30H,4-9H2,1-3H3/b21-15-InChIKey
BICVFLJYNLXXRY-QNGOZBTKSA-NSynonyms
578743-93-8(Z)4ethyl2methyl5((2cyano2(4(4cyclohexylphenyl)thiazol2yl)vinyl)amino)3methylthiophene24dicarboxylate
4ethyl2methyl5(((Z)2cyano2(4(4cyclohexylphenyl)13thiazol2yl)ethenyl)amino)3methylthiophene24dicarboxylate
4Oethyl2Omethyl5(((Z)2cyano2(4(4cyclohexylphenyl)13thiazol2yl)ethenyl)amino)3methylthiophene24dicarboxylate
578743938
CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)C4CCCCC4
InChI=1SC28H29N3O4S2c143527(32)2317(2)24(28(33)343)3726(23)301521(1429)253122(163625)20121019(111320)188657918h101315161830H49H213H3b2115
MFCD04023997
ZINC000101069496
ZINC101069496
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