Vitas-M small molecule compound
methyl 2-({(2E)-3-[4-(acetyloxy)-3-ethoxyphenyl]-2-cyanoprop-2-enoyl}amino)-5-propylthiophene-3-carboxylate
Catalog ID
STK435109
SMILES CCCc1cc(c(s1)NC(=O)/C(=C/c1ccc(c(c1)OCC)OC(=O)C)/C#N)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 C23H24N2O6S MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O6S/c1-5-7-17-12-18(23(28)29-4)22(32-17)25-21(27)16(13-24)10-15-8-9-19(31-14(3)26)20(11-15)30-6-2/h8-12H,5-7H2,1-4H3,(H,25,27)/b16-10+InChIKey
VRZKZVPGQLRRLZ-MHWRWJLKSA-NSynonyms
4((1E)2CYANO2(N(3(METHOXYCARBONYL)5PROPYL(2THIENYL))CARBAMOYL)VINYL)2ETHOXYPHENYLACETATE
CCCC1=CC(=C(S1)NC(=O)C(=CC2=CC(=C(C=C2)OC(=O)C)OCC)C#N)C(=O)OC
CCCc1cc(c(s1)NC(=O)C(=Cc1ccc(c(c1)OCC)OC(=O)C)C#N)C(=O)OC
InChI=1SC23H24N2O6Sc157171218(23(28)294)22(3217)2521(27)16(1324)10158919(3114(3)26)20(1115)3062h812H57H214H3(H2527)b1610+
methyl2(((2E)3(4(acetyloxy)3ethoxyphenyl)2cyanoprop2enoyl)amino)5propylthiophene3carboxylate
METHYL2(((E)3(4ACETYLOXY3ETHOXYPHENYL)2CYANOPROP2ENOYL)AMINO)5PROPYLTHIOPHENE3CARBOXYLATE
MFCD03943025
ZINC000020562630
ZINC20562630
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