Vitas-M small molecule compound
ethyl 5-cyano-4-(furan-2-yl)-2-hydroxy-6-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-phenyl-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK601674
SMILES CCOC(=O)C1C(c2ccco2)C(=C(NC1(O)c1ccccc1)SCC(=O)Nc1cccc(c1)OC)C#N
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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 C28H27N3O6S MW 533.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O6S/c1-3-36-27(33)25-24(22-13-8-14-37-22)21(16-29)26(31-28(25,34)18-9-5-4-6-10-18)38-17-23(32)30-19-11-7-12-20(15-19)35-2/h4-15,24-25,31,34H,3,17H2,1-2H3,(H,30,32)InChIKey
RIKDEXSAEWFQNL-UHFFFAOYSA-NSynonyms
1212167-84-41212167844
CCOC(=O)C1C(C(=C(NC1(C2=CC=CC=C2)O)SCC(=O)NC3=CC(=CC=C3)OC)C#N)C4=CC=CO4
ethyl5cyano4(furan2yl)2hydroxy6((2((3methoxyphenyl)amino)2oxoethyl)sulfanyl)2phenyl1234tetrahydropyridine3carboxylate
ethyl5cyano4(furan2yl)2hydroxy6((2((3methoxyphenyl)amino)2oxoethyl)thio)2phenyl1234tetrahydropyridine3carboxylate
ETHYL5CYANO4(FURAN2YL)2HYDROXY6(2(3METHOXYANILINO)2OXOETHYL)SULFANYL2PHENYL34DIHYDRO1HPYRIDINE3CARBOXYLATE
InChI=1SC28H27N3O6Sc133627(33)2524(22138143722)21(1629)26(3128(2534)1895461018)381723(32)30191171220(1519)352h41524253134H317H212H3(H3032)
MFCD04184906
ZINC000097954661
ZINC000102753484
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