Vitas-M small molecule compound
2-(1,3-benzoxazol-2-ylsulfanyl)-N'-[(E)-{3-chloro-5-methoxy-4-[(4-methylbenzyl)oxy]phenyl}methylidene]acetohydrazide
Catalog ID
STK899436
SMILES COc1cc(/C=N/NC(=O)CSc2nc3c(o2)cccc3)cc(c1OCc1ccc(cc1)C)Cl
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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 C25H22ClN3O4S MW 495.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O4S/c1-16-7-9-17(10-8-16)14-32-24-19(26)11-18(12-22(24)31-2)13-27-29-23(30)15-34-25-28-20-5-3-4-6-21(20)33-25/h3-13H,14-15H2,1-2H3,(H,29,30)/b27-13+InChIKey
YNYNLJYMBVBICX-UVHMKAGCSA-NSynonyms
404022-84-02(13benzoxazol2ylsulfanyl)N((E)(3chloro5methoxy4((4methylbenzyl)oxy)phenyl)methylidene)acetohydrazide
2(13BENZOXAZOL2YLSULFANYL)N((E)(3CHLORO5METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)ACETAMIDE
2(13BENZOXAZOL2YLSULFANYL)N(3CHLORO5METHOXY4((4METHYLBENZYL)OXY)BENZYLIDENE)ACETOHYDRAZIDE
404022840
CC1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)C=NNC(=O)CSC3=NC4=CC=CC=C4O3)OC
COc1cc(C=NNC(=O)CSc2nc3c(o2)cccc3)cc(c1OCc1ccc(cc1)C)Cl
InChI=1SC25H22ClN3O4Sc1167917(10816)14322419(26)1118(1222(24)312)13272923(30)1534252820534621(20)3325h313H1415H212H3(H2930)b2713+
MFCD02604533
ZINC000002077354
ZINC33347849
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