Vitas-M small molecule compound
4-{5-[(E)-(5-imino-2-methyl-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STK099374
SMILES Cc1nn2c(=NC(=O)/C(=C/c3ccc(o3)c3ccc(cc3)C(=O)O)/C2=N)s1
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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 C18H12N4O4S MW 380.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N4O4S/c1-9-21-22-15(19)13(16(23)20-18(22)27-9)8-12-6-7-14(26-12)10-2-4-11(5-3-10)17(24)25/h2-8,19H,1H3,(H,24,25)/b13-8+,19-15+InChIKey
VQPYWQVGSAOVLI-CBKPKFSOSA-NSynonyms
4(5((E)(5imino2methyl7oxo5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)furan2yl)benzoicacid
Cc1nn2c(=NC(=O)C(=Cc3ccc(o3)c3ccc(cc3)C(=O)O)C2=N)s1
MFCD03145621
STK099374
ZINC000019955716
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