Vitas-M small molecule compound
methyl 4-chloro-3-{5-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]furan-2-yl}benzoate
Catalog ID
STL371688
SMILES COC(=O)c1ccc(c(c1)c1ccc(o1)/C=c/1\sc2n(c1=O)c1c(n2)cccc1)Cl
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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 C22H13ClN2O4S MW 436.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13ClN2O4S/c1-28-21(27)12-6-8-15(23)14(10-12)18-9-7-13(29-18)11-19-20(26)25-17-5-3-2-4-16(17)24-22(25)30-19/h2-11H,1H3/b19-11-InChIKey
FLYMZGBRJKTADB-ODLFYWEKSA-NSynonyms
COC(=O)C1=CC(=C(C=C1)Cl)C2=CC=C(O2)C=C3C(=O)N4C5=CC=CC=C5N=C4S3
COC(=O)c1ccc(c(c1)c1ccc(o1)C=c1sc2n(c1=O)c1c(n2)cccc1)Cl
InChI=1SC22H13ClN2O4Sc12821(27)126815(23)14(1012)189713(2918)111920(26)2517532416(17)2422(25)3019h211H1H3b1911
METHYL4CHLORO3(5((Z)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)FURAN2YL)BENZOATE
methyl4chloro3(5((Z)(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)methyl)furan2yl)benzoate
MFCD03062180
ZINC000015009061
ZINC15009061
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