Vitas-M small molecule compound
methyl 2-[({[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK885856
SMILES N#CC1=C(SCC(=O)Nc2ccccc2C(=O)OC)NC(=C(C1c1ccc(cc1)Cl)C(=O)C)C
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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 C25H22ClN3O4S MW 495.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O4S/c1-14-22(15(2)30)23(16-8-10-17(26)11-9-16)19(12-27)24(28-14)34-13-21(31)29-20-7-5-4-6-18(20)25(32)33-3/h4-11,23,28H,13H2,1-3H3,(H,29,31)InChIKey
RFMJDFNHQPVIPV-UHFFFAOYSA-NSynonyms
702648-55-3702648553
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC=C2C(=O)OC)C#N)C3=CC=C(C=C3)Cl)C(=O)C
InChI=1SC25H22ClN3O4Sc11422(15(2)30)23(1681017(26)11916)19(1227)24(2814)341321(31)2920754618(20)25(32)333h4112328H13H213H3(H2931)
methyl2((((5acetyl4(4chlorophenyl)3cyano6methyl14dihydropyridin2yl)sulfanyl)acetyl)amino)benzoate
METHYL2((2((5ACETYL4(4CHLOROPHENYL)3CYANO6METHYL14DIHYDROPYRIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL2(2((5ACETYL4(4CHLOROPHENYL)3CYANO6METHYL14DIHYDROPYRIDIN2YL)THIO)ACETAMIDO)BENZOATE
MFCD04219069
ZINC000009512621
ZINC000009512628
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