Vitas-M small molecule compound
2-tert-butyl 4-ethyl 5-({(Z)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK804036
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccc(c2)Br)/C#N)sc(c1C)C(=O)OC(C)(C)C
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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 C25H24BrN3O4S2 MW 574.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O4S2/c1-6-32-23(30)19-14(2)20(24(31)33-25(3,4)5)35-22(19)28-12-16(11-27)21-29-18(13-34-21)15-8-7-9-17(26)10-15/h7-10,12-13,28H,6H2,1-5H3/b16-12-InChIKey
RZADDFAOUASSIP-VBKFSLOCSA-NSynonyms
2Otertbutyl4Oethyl5(((Z)2(4(3bromophenyl)13thiazol2yl)2cyanoethenyl)amino)3methylthiophene24dicarboxylate
2tertbutyl4ethyl5(((Z)2(4(3bromophenyl)13thiazol2yl)2cyanoethenyl)amino)3methylthiophene24dicarboxylate
CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)Br
CCOC(=O)c1c(NC=C(c2scc(n2)c2cccc(c2)Br)C#N)sc(c1C)C(=O)OC(C)(C)C
InChI=1SC25H24BrN3O4S2c163223(30)1914(2)20(24(31)3325(34)5)3522(19)281216(1127)212918(133421)1587917(26)1015h710121328H6H215H3b1612
MFCD18169534
ZINC000097965053
ZINC97965053
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