Vitas-M small molecule compound
ethyl 5-cyano-6-[(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK886211
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)c1ccccc1)C(=O)OCC)c1ccco1
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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 C30H27N3O6S MW 557.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O6S/c1-3-37-29(35)20-12-14-21(15-13-20)32-24(34)18-40-28-22(17-31)25(23-11-8-16-39-23)26(30(36)38-4-2)27(33-28)19-9-6-5-7-10-19/h5-16,25,33H,3-4,18H2,1-2H3,(H,32,34)InChIKey
CXJUPQJTCWARAL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C3=CC=CC=C3)C(=O)OCC)C4=CC=CO4)C#N
ethyl5cyano6((2((4(ethoxycarbonyl)phenyl)amino)2oxoethyl)sulfanyl)4(furan2yl)2phenyl14dihydropyridine3carboxylate
ETHYL5CYANO6(2(4ETHOXYCARBONYLANILINO)2OXOETHYL)SULFANYL4(FURAN2YL)2PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC30H27N3O6Sc133729(35)20121421(151320)3224(34)18402822(1731)25(23118163923)26(30(36)3842)27(3328)1996571019h5162533H3418H212H3(H3234)
MFCD05033539
ZINC000101156051
ZINC000101156054
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