Vitas-M small molecule compound
ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}-4-phenylthiophene-3-carboxylate
Catalog ID
STL024302
SMILES CCOC(=O)c1c(NC=C2C(=O)CC(CC2=O)(C)C)scc1c1ccccc1
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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 C22H23NO4S MW 397.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4S/c1-4-27-21(26)19-16(14-8-6-5-7-9-14)13-28-20(19)23-12-15-17(24)10-22(2,3)11-18(15)25/h5-9,12-13,23H,4,10-11H2,1-3H3InChIKey
WQIAHOXANSEMAP-UHFFFAOYSA-NSynonyms
2((44DIMETHYL26DIOXOCYCLOHEXYLIDENEMETHYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC=C3C(=O)CC(CC3=O)(C)C
ethyl2(((44dimethyl26dioxocyclohexylidene)methyl)amino)4phenylthiophene3carboxylate
ETHYL2((44DIMETHYL26DIOXOCYCLOHEXYLIDENE)METHYLAMINO)4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H23NO4Sc142721(26)1916(148657914)132820(19)23121517(24)1022(23)1118(15)25h59121323H41011H213H3
MFCD03571676
ZINC000100998814
ZINC100998814
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