Vitas-M small molecule compound
2-chloro-5-{5-[(E)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STL371686
SMILES OC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=c\1/sc2n(c1=O)c1c(n2)cccc1
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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 C21H11ClN2O4S MW 422.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11ClN2O4S/c22-14-7-5-11(9-13(14)20(26)27)17-8-6-12(28-17)10-18-19(25)24-16-4-2-1-3-15(16)23-21(24)29-18/h1-10H,(H,26,27)/b18-10+InChIKey
KYMCFBVZYBLWRS-VCHYOVAHSA-NSynonyms
2chloro5(5((E)(1oxo(13)thiazolo(32a)benzimidazol2ylidene)methyl)furan2yl)benzoicacid
2chloro5(5((E)(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)methyl)furan2yl)benzoicacid
C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)Cl)C(=O)O)S3
InChI=1SC21H11ClN2O4Sc22147511(913(14)20(26)27)178612(2817)101819(25)2416421315(16)2321(24)2918h110H(H2627)b1810+
MFCD03247138
OC(=O)c1cc(ccc1Cl)c1ccc(o1)C=c1sc2n(c1=O)c1c(n2)cccc1
ZINC000033340027
ZINC33340027
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