Vitas-M small molecule compound
2-{4-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenoxy}-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STL428904
SMILES COc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)/C=C/1\SC(=S)N(C1=O)Cc1ccccc1
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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 C28H26N2O4S2 MW 518.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O4S2/c1-18-9-11-22(13-19(18)2)29-26(31)17-34-23-12-10-21(14-24(23)33-3)15-25-27(32)30(28(35)36-25)16-20-7-5-4-6-8-20/h4-15H,16-17H2,1-3H3,(H,29,31)/b25-15-InChIKey
CKNHKHGTLAOUAX-MYYYXRDXSA-NSynonyms
2(4((Z)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)2methoxyphenoxy)N(34dimethylphenyl)acetamide
2(4((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenoxy)N(34dimethylphenyl)acetamide
CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)OC)C
COc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC28H26N2O4S2c11891122(1319(18)2)2926(31)173423121021(1424(23)333)152527(32)30(28(35)3625)16207546820h415H1617H213H3(H2931)b2515
MFCD04550925
ZINC000033677432
ZINC33677432
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