Vitas-M small molecule compound
ethyl (5E)-5-[4-(dimethylamino)benzylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK078475
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C/c2ccc(cc2)N(C)C)/C1=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 C22H22N2O3S MW 394.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O3S/c1-4-27-22(26)19-20(25)18(14-15-10-12-17(13-11-15)24(2)3)28-21(19)23-16-8-6-5-7-9-16/h5-14,23H,4H2,1-3H3/b18-14+InChIKey
IUWCDJHSYKBNGI-NBVRZTHBSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(cc2)N(C)C)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)N(C)C)C1=O)NC3=CC=CC=C3
ethyl(5E)2anilino5((4(dimethylamino)phenyl)methylidene)4oxothiophene3carboxylate
ETHYL(5E)2ANILINO5((4DIMETHYLAMINOPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5E)5(4(DIMETHYLAMINO)BENZYLIDENE)4OXO2(PHENYLAMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC22H22N2O3Sc142722(26)1920(25)18(1415101217(131115)24(2)3)2821(19)23168657916h51423H4H213H3b1814+
MFCD03032739
STK078475
ZINC000002745700
ZINC02745700
ZINC2745700
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