Vitas-M small molecule compound
2-methylpropyl 4-({(Z)-2-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Catalog ID
STK878571
SMILES N#C/C(=C/Nc1ccc(cc1)C(=O)OCC(C)C)/c1scc(n1)c1cc2cc(Cl)ccc2oc1=O
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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 C26H20ClN3O4S MW 505.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O4S/c1-15(2)13-33-25(31)16-3-6-20(7-4-16)29-12-18(11-28)24-30-22(14-35-24)21-10-17-9-19(27)5-8-23(17)34-26(21)32/h3-10,12,14-15,29H,13H2,1-2H3/b18-12-InChIKey
SHKQZFWVFUCHJD-PDGQHHTCSA-NSynonyms
2methylpropyl4(((Z)2(4(6chloro2oxo2Hchromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
2methylpropyl4(((Z)2(4(6chloro2oxochromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
CC(C)COC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Cl)OC3=O
InChI=1SC26H20ClN3O4Sc115(2)133325(31)163620(7416)291218(1128)243022(143524)211017919(27)5823(17)3426(21)32h31012141529H13H212H3b1812
MFCD18170349
N#CC(=CNc1ccc(cc1)C(=O)OCC(C)C)c1scc(n1)c1cc2cc(Cl)ccc2oc1=O
ZINC000040476990
ZINC40476990
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