Vitas-M small molecule compound
prop-2-en-1-yl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK840969
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1nccs1
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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 C22H19ClN4O3S2 MW 487.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O3S2/c1-3-9-30-21(29)18-13(2)26-20(32-12-17(28)27-22-25-8-10-31-22)16(11-24)19(18)14-4-6-15(23)7-5-14/h3-8,10,19,26H,1,9,12H2,2H3,(H,25,27,28)InChIKey
QPJHKTPUNHSZEP-UHFFFAOYSA-NSynonyms
442556-53-8442556538
ALLYL4(4CHLOROPHENYL)5CYANO2METHYL6((2OXO2(13THIAZOL2YLAMINO)ETHYL)SULFANYL)14DIHYDROPYRIDINE3CARBOXYLATE
ALLYL4(4CHLOROPHENYL)5CYANO2METHYL6((2OXO2(THIAZOL2YLAMINO)ETHYL)THIO)14DIHYDROPYRIDINE3CARBOXYLATE
CC1=C(C(C(=C(N1)SCC(=O)NC2=NC=CS2)C#N)C3=CC=C(C=C3)Cl)C(=O)OCC=C
InChI=1SC22H19ClN4O3S2c1393021(29)1813(2)2620(321217(28)2722258103122)16(1124)19(18)144615(23)7514h38101926H1912H22H3(H252728)
MFCD03287543
prop2en1yl4(4chlorophenyl)5cyano2methyl6((2oxo2(13thiazol2ylamino)ethyl)sulfanyl)14dihydropyridine3carboxylate
prop2enyl4(4chlorophenyl)5cyano2methyl6(2oxo2(13thiazol2ylamino)ethyl)sulfanyl14dihydropyridine3carboxylate
ZINC000100537162
ZINC000100537166
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