Vitas-M small molecule compound
prop-2-en-1-yl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK887243
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccccc1C
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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 C26H24ClN3O3S MW 494.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O3S/c1-4-13-33-26(32)23-17(3)29-25(19(14-28)24(23)18-10-6-7-11-20(18)27)34-15-22(31)30-21-12-8-5-9-16(21)2/h4-12,24,29H,1,13,15H2,2-3H3,(H,30,31)InChIKey
XCVUEBAWIAKNLR-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3Cl)C#N
InChI=1SC26H24ClN3O3Sc14133326(32)2317(3)2925(19(1428)24(23)1810671120(18)27)341522(31)30211285916(21)2h4122429H11315H223H3(H3031)
MFCD10088089
prop2en1yl4(2chlorophenyl)5cyano2methyl6((2((2methylphenyl)amino)2oxoethyl)sulfanyl)14dihydropyridine3carboxylate
prop2enyl4(2chlorophenyl)5cyano2methyl6(2(2methylanilino)2oxoethyl)sulfanyl14dihydropyridine3carboxylate
ZINC000020348462
ZINC000020348463
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