Vitas-M small molecule compound
2-{[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Catalog ID
STK826507
SMILES N#CC1=C(SCC(=O)Nc2sc3c(c2C#N)CCCC3)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 C26H23ClN4O2S2 MW 523.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN4O2S2/c1-14-23(15(2)32)24(16-7-9-17(27)10-8-16)20(12-29)25(30-14)34-13-22(33)31-26-19(11-28)18-5-3-4-6-21(18)35-26/h7-10,24,30H,3-6,13H2,1-2H3,(H,31,33)InChIKey
RCTFGISTCVZWPA-UHFFFAOYSA-NSynonyms
2((5acetyl4(4chlorophenyl)3cyano6methyl14dihydropyridin2yl)sulfanyl)N(3cyano4567tetrahydro1benzothiophen2yl)acetamide
CC1=C(C(C(=C(N1)SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)C#N)C4=CC=C(C=C4)Cl)C(=O)C
InChI=1SC26H23ClN4O2S2c11423(15(2)32)24(167917(27)10816)20(1229)25(3014)341322(33)312619(1128)18534621(18)3526h7102430H3613H212H3(H3133)
MFCD04218594
ZINC000012250264
ZINC000012250265
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