Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-6-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STL338078
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)c1ccc(cc1)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 C26H24N2O4S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O4S/c1-4-14-32-26(30)23-17(2)28-25(21(15-27)24(23)19-8-6-5-7-9-19)33-16-22(29)18-10-12-20(31-3)13-11-18/h4-13,24,28H,1,14,16H2,2-3H3InChIKey
VFRLCVRAOXGTAW-UHFFFAOYSA-NSynonyms
799825-28-8799825288
allyl5cyano6((2(4methoxyphenyl)2oxoethyl)thio)2methyl4phenyl14dihydropyridine3carboxylate
CC1=C(C(C(=C(N1)SCC(=O)C2=CC=C(C=C2)OC)C#N)C3=CC=CC=C3)C(=O)OCC=C
InChI=1SC26H24N2O4Sc14143226(30)2317(2)2825(21(1527)24(23)198657919)331622(29)18101220(313)131118h4132428H11416H223H3
MFCD03683006
prop2en1yl5cyano6((2(4methoxyphenyl)2oxoethyl)sulfanyl)2methyl4phenyl14dihydropyridine3carboxylate
PROP2ENYL5CYANO6(2(4METHOXYPHENYL)2OXOETHYL)SULFANYL2METHYL4PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000002238725
ZINC000002238726
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