Vitas-M small molecule compound
methyl {2-chloro-6-ethoxy-4-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenoxy}acetate
Catalog ID
STK161346
SMILES CCOc1cc(cc(c1OCC(=O)OC)Cl)/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 C21H17ClN2O5S MW 444.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O5S/c1-3-28-16-9-12(8-13(22)19(16)29-11-18(25)27-2)10-17-20(26)24-15-7-5-4-6-14(15)23-21(24)30-17/h4-10H,3,11H2,1-2H3/b17-10-InChIKey
RNXRMMHXZRGZTQ-YVLHZVERSA-NSynonyms
CCOC1=C(C(=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)Cl)OCC(=O)OC
CCOc1cc(cc(c1OCC(=O)OC)Cl)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC21H17ClN2O5Sc132816912(813(22)19(16)291118(25)272)101720(26)2415754614(15)2321(24)3017h410H311H212H3b1710
METHYL(2CHLORO6ETHOXY4((Z)(3OXO(13)THIAZOLO(32A)BENZIMIDAZOL2(3H)YLIDENE)METHYL)PHENOXY)ACETATE
METHYL2(2CHLORO6ETHOXY4((Z)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)PHENOXY)ACETATE
MFCD02891613
ZINC000014009449
ZINC14009449
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