Vitas-M small molecule compound
2-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(Z)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]phenyl}methylidene]acetohydrazide
Catalog ID
STK379169
SMILES O=C(CSc1nc2c(s1)cccc2)N/N=C\c1ccc(cc1)Oc1nc(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 C20H13ClFN5O2S2 MW 473.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClFN5O2S2/c21-19-23-10-14(22)18(26-19)29-13-7-5-12(6-8-13)9-24-27-17(28)11-30-20-25-15-3-1-2-4-16(15)31-20/h1-10H,11H2,(H,27,28)/b24-9-InChIKey
OEFKPQCORHJQMT-OPVMPGTRSA-NSynonyms
2(13benzothiazol2ylsulfanyl)N((Z)(4((2chloro5fluoropyrimidin4yl)oxy)phenyl)methylidene)acetohydrazide
2(13BENZOTHIAZOL2YLSULFANYL)N((Z)(4(2CHLORO5FLUOROPYRIMIDIN4YL)OXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
C1=CC=C2C(=C1)N=C(S2)SCC(=O)NN=CC3=CC=C(C=C3)OC4=NC(=NC=C4F)Cl
InChI=1SC20H13ClFN5O2S2c2119231014(22)18(2619)29137512(6813)9242717(28)1130202515312416(15)3120h110H11H2(H2728)b249
MFCD02067557
O=C(CSc1nc2c(s1)cccc2)NN=Cc1ccc(cc1)Oc1nc(Cl)ncc1F
ZINC000030738288
ZINC34254510
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