Vitas-M small molecule compound
ethyl (5Z)-5-(4-tert-butylbenzylidene)-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK063787
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccc(cc2)C(C)(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 C24H25NO3S MW 407.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO3S/c1-5-28-23(27)20-21(26)19(29-22(20)25-18-9-7-6-8-10-18)15-16-11-13-17(14-12-16)24(2,3)4/h6-15,25H,5H2,1-4H3/b19-15-InChIKey
UMTNXTVWKNRDGH-CYVLTUHYSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(cc2)C(C)(C)C)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)C(C)(C)C)C1=O)NC3=CC=CC=C3
ETHYL(5Z)2ANILINO5((4TERTBUTYLPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(4TERTBUTYLBENZYLIDENE)4OXO2(PHENYLAMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC24H25NO3Sc152823(27)2021(26)19(2922(20)251897681018)1516111317(141216)24(23)4h61525H5H214H3b1915
MFCD02214860
STK063787
ZINC000005074071
ZINC05074071
ZINC5074071
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