Vitas-M small molecule compound
{4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid
Catalog ID
STK037021
SMILES N#C/C(=C\c1ccc(cc1)OCC(=O)O)/c1nc2c(s1)cccc2
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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 C18H12N2O3S MW 336.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N2O3S/c19-10-13(18-20-15-3-1-2-4-16(15)24-18)9-12-5-7-14(8-6-12)23-11-17(21)22/h1-9H,11H2,(H,21,22)/b13-9+InChIKey
DFFYNCNTRDHZNE-UKTHLTGXSA-NSynonyms
(4((E)2(13BENZOTHIAZOL2YL)2CYANOETHENYL)PHENOXY)ACETICACID
2(4((E)2(13BENZOTHIAZOL2YL)2CYANOETHENYL)PHENOXY)ACETICACID
C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC=C(C=C3)OCC(=O)O)C#N
InChI=1SC18H12N2O3Sc191013(182015312416(15)2418)9125714(8612)231117(21)22h19H11H2(H2122)b139+
MFCD04498939
N#CC(=Cc1ccc(cc1)OCC(=O)O)c1nc2c(s1)cccc2
STK037021
ZINC000004615857
ZINC4615857
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