Vitas-M small molecule compound

(5Z)-2-(2-methoxyphenyl)-5-(2-nitrobenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK801021
SMILES COc1ccccc1c1nn2c(n1)s/c(=C\c1ccccc1[N+](=O)[O-])/c2=O

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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 C18H12N4O4S MW 380.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N4O4S/c1-26-14-9-5-3-7-12(14)16-19-18-21(20-16)17(23)15(27-18)10-11-6-2-4-8-13(11)22(24)25/h2-10H,1H3/b15-10-
InChIKey
VCQXBFDLHLMNGV-GDNBJRDFSA-N
Synonyms
577696-22-1
(5Z)2(2METHOXYPHENYL)5((2NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(2methoxyphenyl)5(2nitrobenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(2methoxyphenyl)5(2nitrobenzylidene)thiazolo(32b)(124)triazol6(5H)one
577696221
COC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC=CC=C4(N+)(=O)(O))SC3=N2
COc1ccccc1c1nn2c(n1)sc(=Cc1ccccc1(N+)(=O)(O))c2=O
InChI=1SC18H12N4O4Sc12614953712(14)16191821(2016)17(23)15(2718)1011624813(11)22(24)25h210H1H3b1510
MFCD04027617
ZINC000001898588
ZINC01898588
ZINC1898588

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Available files

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