Vitas-M small molecule compound

methyl 5-cyano-2-hydroxy-4-(2-methylphenyl)-6-{[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl}-3,4-dihydropyridine-3-carboxylate

Catalog ID
STL044888
SMILES COC(=O)C1C(=NC(=C(C1c1ccccc1C)C#N)SCC(=O)Nc1nccs1)O

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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 C20H18N4O4S2 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4S2/c1-11-5-3-4-6-12(11)15-13(9-21)18(24-17(26)16(15)19(27)28-2)30-10-14(25)23-20-22-7-8-29-20/h3-8,15-16H,10H2,1-2H3,(H,24,26)(H,22,23,25)
InChIKey
ARRRUZODXFSHSU-UHFFFAOYSA-N
Synonyms
375357-47-4
CC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=NC=CS3)C(=O)OC
InChI=1SC20H18N4O4S2c111534612(11)1513(921)18(2417(26)16(15)19(27)282)301014(25)232022782920h381516H10H212H3(H2426)(H222325)
methyl5cyano2hydroxy4(2methylphenyl)6((2oxo2(13thiazol2ylamino)ethyl)sulfanyl)34dihydropyridine3carboxylate
METHYL5CYANO4(2METHYLPHENYL)2OXO6(2OXO2(13THIAZOL2YLAMINO)ETHYL)SULFANYL34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD03817462
ZINC000002296161
ZINC000002296164

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Available files

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