Vitas-M small molecule compound

(2E)-2-(4-nitrobenzylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one

Catalog ID
STK804656
SMILES [O-][N+](=O)c1ccc(cc1)/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 C16H9N3O3S MW 323.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9N3O3S/c20-15-14(9-10-5-7-11(8-6-10)19(21)22)23-16-17-12-3-1-2-4-13(12)18(15)16/h1-9H/b14-9+
InChIKey
OEGMARAJWDSTIW-NTEUORMPSA-N
Synonyms
167425-89-0
(2E)2((4NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2E)2(4nitrobenzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(E)2(4nitrobenzylidene)benzo(45)imidazo(21b)thiazol3(2H)one
(O)(N+)(=O)c1ccc(cc1)C=c1sc2n(c1=O)c1c(n2)cccc1
167425890
2((4NITROPHENYL)METHYLENE)13THIAZOLIDINO(32A)BENZIMIDAZOL3ONE
2(4NITROBENZYLIDENE)BENZO(45)IMIDAZO(21B)THIAZOL3ONE
C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))S3
InChI=1SC16H9N3O3Sc201514(9105711(8610)19(21)22)23161712312413(12)18(15)16h19Hb149+
MFCD00221449
ZINC000012370110
ZINC12370110

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.