Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-2-methyl-6-[(2-oxo-2-phenylethyl)sulfanyl]-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK538176
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)c1ccccc1
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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 C23H20N2O3S2 MW 436.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O3S2/c1-3-11-28-23(27)20-15(2)25-22(17(13-24)21(20)19-10-7-12-29-19)30-14-18(26)16-8-5-4-6-9-16/h3-10,12,21,25H,1,11,14H2,2H3InChIKey
JOYOWRYCZKBGBG-UHFFFAOYSA-NSynonyms
383892-70-4383892704
allyl5cyano2methyl6((2oxo2phenylethyl)thio)4(thiophen2yl)14dihydropyridine3carboxylate
CC1=C(C(C(=C(N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=CS3)C(=O)OCC=C
InChI=1SC23H20N2O3S2c13112823(27)2015(2)2522(17(1324)21(20)19107122919)301418(26)168546916h310122125H11114H22H3
MFCD03000531
prop2en1yl5cyano2methyl6((2oxo2phenylethyl)sulfanyl)4(thiophen2yl)14dihydropyridine3carboxylate
PROP2ENYL5CYANO2METHYL6PHENACYLSULFANYL4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000020029010
ZINC000020029011
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