Vitas-M small molecule compound
(2Z)-2-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK712084
SMILES COc1cc(ccc1OCCOc1ccc(cc1)[N+](=O)[O-])/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 C25H19N3O6S MW 489.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O6S/c1-32-22-14-16(15-23-24(29)27-20-5-3-2-4-19(20)26-25(27)35-23)6-11-21(22)34-13-12-33-18-9-7-17(8-10-18)28(30)31/h2-11,14-15H,12-13H2,1H3/b23-15-InChIKey
JUZRQEAPTMEMDF-HAHDFKILSA-NSynonyms
(2Z)2((3METHOXY4(2(4NITROPHENOXY)ETHOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(3methoxy4(2(4nitrophenoxy)ethoxy)benzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(E)2(3methoxy4(2(4nitrophenoxy)ethoxy)benzylidene)benzo(45)imidazo(21b)thiazol3(2H)one
COC1=C(C=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)OCCOC5=CC=C(C=C5)(N+)(=O)(O)
COc1cc(ccc1OCCOc1ccc(cc1)(N+)(=O)(O))C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC25H19N3O6Sc132221416(152324(29)2720532419(20)2625(27)3523)61121(22)34131233189717(81018)28(30)31h2111415H1213H21H3b2315
MFCD02121624
ZINC000022185130
ZINC22185130
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