Vitas-M small molecule compound

butyl 4-({(E)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate

Catalog ID
STK878557
SMILES CCCCOC(=O)c1ccc(cc1)N/C=C(/c1scc(n1)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 C21H19N3O2S2 MW 409.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O2S2/c1-2-3-10-26-21(25)15-6-8-17(9-7-15)23-13-16(12-22)20-24-18(14-28-20)19-5-4-11-27-19/h4-9,11,13-14,23H,2-3,10H2,1H3/b16-13+
InChIKey
ZGHWSKOCJBGTLA-DTQAZKPQSA-N
Synonyms
1021251-47-7
1021251477
butyl4(((E)2cyano2(4(thiophen2yl)13thiazol2yl)ethenyl)amino)benzoate
butyl4(((E)2cyano2(4thiophen2yl13thiazol2yl)ethenyl)amino)benzoate
CCCCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=CS3
CCCCOC(=O)c1ccc(cc1)NC=C(c1scc(n1)c1cccs1)C#N
InChI=1SC21H19N3O2S2c123102621(25)156817(9715)231316(1222)202418(142820)1954112719h4911131423H2310H21H3b1613+
MFCD11992906
ZINC000017270538
ZINC17270538

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Available files

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