Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-2-{[3-cyano-6-hydroxy-4-(2-methylphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}acetamide
Catalog ID
STK850508
SMILES N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)N=C(CC1c1ccccc1C)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 C22H20ClN3O2S MW 425.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O2S/c1-13-5-3-4-6-16(13)17-10-20(27)26-22(18(17)11-24)29-12-21(28)25-15-8-7-14(2)19(23)9-15/h3-9,17H,10,12H2,1-2H3,(H,25,28)(H,26,27)InChIKey
IQBSLSRPNSKUOB-UHFFFAOYSA-NSynonyms
489405-30-3489405303
CC1=C(C=C(C=C1)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=CC=C3C)C#N)Cl
InChI=1SC22H20ClN3O2Sc113534616(13)171020(27)2622(18(17)1124)291221(28)25158714(2)19(23)915h3917H1012H212H3(H2528)(H2627)
MFCD07201213
N(3chloro4methylphenyl)2((3cyano6hydroxy4(2methylphenyl)45dihydropyridin2yl)sulfanyl)acetamide
N(3CHLORO4METHYLPHENYL)2((5CYANO4(2METHYLPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETAMIDE
ZINC000009110282
ZINC000009110283
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