Vitas-M small molecule compound
2-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(Z)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-methoxyphenyl}methylidene]acetohydrazide
Catalog ID
STK379175
SMILES COc1cc(/C=N\NC(=O)CSc2nc3c(s2)cccc3)ccc1Oc1nc(Cl)ncc1F
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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 C21H15ClFN5O3S2 MW 503.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClFN5O3S2/c1-30-16-8-12(6-7-15(16)31-19-13(23)10-24-20(22)27-19)9-25-28-18(29)11-32-21-26-14-4-2-3-5-17(14)33-21/h2-10H,11H2,1H3,(H,28,29)/b25-9-InChIKey
PQOOIZBIKUTALH-MWYAZZEHSA-NSynonyms
2(13benzothiazol2ylsulfanyl)N((Z)(4((2chloro5fluoropyrimidin4yl)oxy)3methoxyphenyl)methylidene)acetohydrazide
2(13BENZOTHIAZOL2YLSULFANYL)N((Z)(4(2CHLORO5FLUOROPYRIMIDIN4YL)OXY3METHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
COC1=C(C=CC(=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3S2)OC4=NC(=NC=C4F)Cl
COc1cc(C=NNC(=O)CSc2nc3c(s2)cccc3)ccc1Oc1nc(Cl)ncc1F
InChI=1SC21H15ClFN5O3S2c13016812(6715(16)311913(23)102420(22)2719)9252818(29)1132212614423517(14)3321h210H11H21H3(H2829)b259
MFCD02067567
ZINC000030738302
ZINC33860907
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