Vitas-M small molecule compound
methyl 5-cyano-4-(4-methoxyphenyl)-6-[(naphthalen-2-ylmethyl)sulfanyl]-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STL381280
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)OC)C#N)SCc1ccc2c(c1)cccc2
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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 C26H22N2O4S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O4S/c1-31-20-11-9-18(10-12-20)22-21(14-27)25(28-24(29)23(22)26(30)32-2)33-15-16-7-8-17-5-3-4-6-19(17)13-16/h3-13,22-23H,15H2,1-2H3,(H,28,29)InChIKey
NZNSZTRDLPRPMB-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC3=CC4=CC=CC=C4C=C3)C(=O)OC
InChI=1SC26H22N2O4Sc1312011918(101220)2221(1427)25(2824(29)23(22)26(30)322)3315167817534619(17)1316h3132223H15H212H3(H2829)
methyl5cyano4(4methoxyphenyl)6((naphthalen2ylmethyl)sulfanyl)2oxo1234tetrahydropyridine3carboxylate
METHYL5CYANO4(4METHOXYPHENYL)6(NAPHTHALEN2YLMETHYLSULFANYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD04091410
ZINC000000639165
ZINC000000639172
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