Vitas-M small molecule compound

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

Catalog ID
STK703990
SMILES Cc1ccccc1c1nn2c(n1)s/c(=C\c1ccc(cc1)[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 C18H12N4O3S MW 364.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N4O3S/c1-11-4-2-3-5-14(11)16-19-18-21(20-16)17(23)15(26-18)10-12-6-8-13(9-7-12)22(24)25/h2-10H,1H3/b15-10-
InChIKey
QDIJNJLQEBEUBB-GDNBJRDFSA-N
Synonyms
587001-57-8
(5Z)2(2METHYLPHENYL)5((4NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(2methylphenyl)5(4nitrobenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(4nitrobenzylidene)2(otolyl)thiazolo(32b)(124)triazol6(5H)one
587001578
CC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))SC3=N2
Cc1ccccc1c1nn2c(n1)sc(=Cc1ccc(cc1)(N+)(=O)(O))c2=O
InChI=1SC18H12N4O3Sc111423514(11)16191821(2016)17(23)15(2618)10126813(9712)22(24)25h210H1H3b1510
MFCD04034010
ZINC000001315693
ZINC01315693
ZINC1315693

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Available files

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