Vitas-M small molecule compound
2-[3-(4-fluoro-2-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]-N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]acetamide
Catalog ID
STL162116
SMILES COc1cc(F)ccc1c1ccc(=O)n(n1)CC(=O)/N=c/1\sc2c([nH]1)ccc(c2)OC
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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 C21H17FN4O4S MW 440.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN4O4S/c1-29-13-4-6-16-18(10-13)31-21(23-16)24-19(27)11-26-20(28)8-7-15(25-26)14-5-3-12(22)9-17(14)30-2/h3-10H,11H2,1-2H3,(H,23,24,27)InChIKey
KUZQHIJDZQDSRK-UHFFFAOYSA-NSynonyms
1246057-75-91246057759
2(3(4fluoro2methoxyphenyl)6oxopyridazin1(6H)yl)N((2Z)6methoxy13benzothiazol2(3H)ylidene)acetamide
2(3(4fluoro2methoxyphenyl)6oxopyridazin1yl)N(6methoxy13benzothiazol2yl)acetamide
COC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=O)C=CC(=N3)C4=C(C=C(C=C4)F)OC
COc1cc(F)ccc1c1ccc(=O)n(n1)CC(=O)N=c1sc2c((nH)1)ccc(c2)OC
InChI=1SC21H17FN4O4Sc12913461618(1013)3121(2316)2419(27)112620(28)8715(2526)145312(22)917(14)302h310H11H212H3(H232427)
MFCD20759581
ZINC000049547737
ZINC49547737
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