Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-2-{2-ethoxy-4-[(E)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenoxy}acetamide
Catalog ID
STL376324
SMILES CCOc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)/C=C\1/Sc2c(C1=O)cccc2
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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 C27H25NO4S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO4S/c1-4-31-23-14-19(15-25-27(30)21-7-5-6-8-24(21)33-25)10-12-22(23)32-16-26(29)28-20-11-9-17(2)18(3)13-20/h5-15H,4,16H2,1-3H3,(H,28,29)/b25-15+InChIKey
FBGXCPXEKDRMNJ-MFKUBSTISA-NSynonyms
CCOC1=C(C=CC(=C1)C=C2C(=O)C3=CC=CC=C3S2)OCC(=O)NC4=CC(=C(C=C4)C)C
CCOc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)C=C1Sc2c(C1=O)cccc2
InChI=1SC27H25NO4Sc1431231419(152527(30)21756824(21)3325)101222(23)321626(29)282011917(2)18(3)1320h515H416H213H3(H2829)b2515+
MFCD04374849
N(34dimethylphenyl)2(2ethoxy4((E)(3oxo1benzothiophen2(3H)ylidene)methyl)phenoxy)acetamide
N(34DIMETHYLPHENYL)2(2ETHOXY4((E)(3OXO1BENZOTHIOPHEN2YLIDENE)METHYL)PHENOXY)ACETAMIDE
ZINC000015230443
ZINC15230443
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