Vitas-M small molecule compound
ethyl (5Z)-5-[4-(diethylamino)benzylidene]-2-{[(4-methoxyphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL369467
SMILES CCOC(=O)C1=C(S/C(=C\c2ccc(cc2)N(CC)CC)/C1=O)NC(=O)c1ccc(cc1)OC
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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 C26H28N2O5S MW 480.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O5S/c1-5-28(6-2)19-12-8-17(9-13-19)16-21-23(29)22(26(31)33-7-3)25(34-21)27-24(30)18-10-14-20(32-4)15-11-18/h8-16H,5-7H2,1-4H3,(H,27,30)/b21-16-InChIKey
HPKVITBAFWYQFT-PGMHBOJBSA-NSynonyms
CCN(CC)C1=CC=C(C=C1)C=C2C(=O)C(=C(S2)NC(=O)C3=CC=C(C=C3)OC)C(=O)OCC
CCOC(=O)C1=C(SC(=Cc2ccc(cc2)N(CC)CC)C1=O)NC(=O)c1ccc(cc1)OC
ETHYL(5Z)5((4(DIETHYLAMINO)PHENYL)METHYLIDENE)2((4METHOXYBENZOYL)AMINO)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(4(diethylamino)benzylidene)2(((4methoxyphenyl)carbonyl)amino)4oxo45dihydrothiophene3carboxylate
InChI=1SC26H28N2O5Sc1528(62)1912817(91319)162123(29)22(26(31)3373)25(3421)2724(30)18101420(324)151118h816H57H214H3(H2730)b2116
MFCD05150023
ZINC000009296193
ZINC09296193
ZINC9296193
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