Vitas-M small molecule compound
2-methoxyethyl 4-[4-(benzyloxy)phenyl]-5-cyano-2-methyl-6-(methylsulfanyl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK887421
SMILES COCCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)OCc1ccccc1)C#N)SC
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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 C25H26N2O4S MW 450.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O4S/c1-17-22(25(28)30-14-13-29-2)23(21(15-26)24(27-17)32-3)19-9-11-20(12-10-19)31-16-18-7-5-4-6-8-18/h4-12,23,27H,13-14,16H2,1-3H3InChIKey
KVEAGOCWJTXSOZ-UHFFFAOYSA-NSynonyms
2methoxyethyl4(4(benzyloxy)phenyl)5cyano2methyl6(methylsulfanyl)14dihydropyridine3carboxylate
2methoxyethyl5cyano2methyl6methylsulfanyl4(4phenylmethoxyphenyl)14dihydropyridine3carboxylate
CC1=C(C(C(=C(N1)SC)C#N)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OCCOC
InChI=1SC25H26N2O4Sc11722(25(28)301413292)23(21(1526)24(2717)323)1991120(121019)3116187546818h4122327H131416H213H3
MFCD18172053
ZINC000040486420
ZINC000040486422
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