Vitas-M small molecule compound
ethyl 2-{[(2E)-2-cyano-3-(thiophen-2-yl)prop-2-enoyl]amino}-4-(4-fluorophenyl)thiophene-3-carboxylate
Catalog ID
STK524431
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)/C(=C/c1cccs1)/C#N
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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 C21H15FN2O3S2 MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN2O3S2/c1-2-27-21(26)18-17(13-5-7-15(22)8-6-13)12-29-20(18)24-19(25)14(11-23)10-16-4-3-9-28-16/h3-10,12H,2H2,1H3,(H,24,25)/b14-10+InChIKey
FSDPOXVNVOCPIX-GXDHUFHOSA-NSynonyms
(E)ethyl2(2cyano3(thiophen2yl)acrylamido)4(4fluorophenyl)thiophene3carboxylate
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C(=CC3=CC=CS3)C#N
CCOC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)C(=Cc1cccs1)C#N
ethyl2(((2E)2cyano3(thiophen2yl)prop2enoyl)amino)4(4fluorophenyl)thiophene3carboxylate
ETHYL2(((E)2CYANO3THIOPHEN2YLPROP2ENOYL)AMINO)4(4FLUOROPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2((2E)2CYANO3(2THIENYL)PROP2ENOYLAMINO)4(4FLUOROPHENYL)THIOPHENE3CARBOXYLATE
InChI=1SC21H15FN2O3S2c122721(26)1817(135715(22)8613)122920(18)2419(25)14(1123)10164392816h31012H2H21H3(H2425)b1410+
MFCD01959386
ZINC000002288609
ZINC02288609
ZINC2288609
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