Vitas-M small molecule compound
ethyl 4-({(E)-2-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Catalog ID
STK878503
SMILES CCOC(=O)c1ccc(cc1)N/C=C(/c1scc(n1)c1cc2cc(Cl)ccc2oc1=O)\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 C24H16ClN3O4S MW 477.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16ClN3O4S/c1-2-31-23(29)14-3-6-18(7-4-14)27-12-16(11-26)22-28-20(13-33-22)19-10-15-9-17(25)5-8-21(15)32-24(19)30/h3-10,12-13,27H,2H2,1H3/b16-12+InChIKey
JAENGOSVXNKOLT-FOWTUZBSSA-NSynonyms
1021230-58-91021230589
CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Cl)OC3=O
CCOC(=O)c1ccc(cc1)NC=C(c1scc(n1)c1cc2cc(Cl)ccc2oc1=O)C#N
ethyl4(((E)2(4(6chloro2oxo2Hchromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
ethyl4(((E)2(4(6chloro2oxochromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
InChI=1SC24H16ClN3O4Sc123123(29)143618(7414)271216(1126)222820(133322)191015917(25)5821(15)3224(19)30h310121327H2H21H3b1612+
MFCD11992864
ZINC000017306476
ZINC17306476
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