Vitas-M small molecule compound
4-{5-[(E)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STK177540
SMILES OC(=O)c1ccc(cc1)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 C21H12N2O4S MW 388.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12N2O4S/c24-19-18(28-21-22-15-3-1-2-4-16(15)23(19)21)11-14-9-10-17(27-14)12-5-7-13(8-6-12)20(25)26/h1-11H,(H,25,26)/b18-11+InChIKey
PBRCPUKRPJYRTF-WOJGMQOQSA-NSynonyms
4(5((E)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)FURAN2YL)BENZOICACID
4(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)C(=O)O)S3
InChI=1SC21H12N2O4Sc241918(28212215312416(15)23(19)21)111491017(2714)125713(8612)20(25)26h111H(H2526)b1811+
MFCD02996215
OC(=O)c1ccc(cc1)c1ccc(o1)C=c1sc2n(c1=O)c1c(n2)cccc1
ZINC000027332763
ZINC27332763
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