Vitas-M small molecule compound
ethyl 4-(4-bromophenyl)-2-{[(2E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STK451376
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)/C=C/c1c(F)cccc1Cl
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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 C22H16BrClFNO3S MW 508.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrClFNO3S/c1-2-29-22(28)20-16(13-6-8-14(23)9-7-13)12-30-21(20)26-19(27)11-10-15-17(24)4-3-5-18(15)25/h3-12H,2H2,1H3,(H,26,27)/b11-10+InChIKey
UYGOLKNTQMVRTN-ZHACJKMWSA-NSynonyms
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C=CC3=C(C=CC=C3Cl)F
CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)C=Cc1c(F)cccc1Cl
ETHYL2((2E)3(2CHLORO6FLUOROPHENYL)PROP2ENOYLAMINO)4(4BROMOPHENYL)THIOPHENE3CARBOXYLATE
ethyl4(4bromophenyl)2(((2E)3(2chloro6fluorophenyl)prop2enoyl)amino)thiophene3carboxylate
ETHYL4(4BROMOPHENYL)2(((E)3(2CHLORO6FLUOROPHENYL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL4(4BROMOPHENYL)2((3(2CHLORO6FLUOROPHENYL)ACRYLOYL)AMINO)3THIOPHENECARBOXYLATE
InChI=1SC22H16BrClFNO3Sc122922(28)2016(136814(23)9713)123021(20)2619(27)11101517(24)43518(15)25h312H2H21H3(H2627)b1110+
MFCD03394591
ZINC000002115193
ZINC02115193
ZINC2115193
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