Vitas-M small molecule compound
(5Z)-2-(4-methoxyphenyl)-5-(4-nitrobenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK812199
SMILES COc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1ccc(cc1)[N+](=O)[O-])/s2
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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/c1-26-14-8-4-12(5-9-14)16-19-18-21(20-16)17(23)15(27-18)10-11-2-6-13(7-3-11)22(24)25/h2-10H,1H3/b15-10-InChIKey
QTUOCVKWXSVSOR-GDNBJRDFSA-NSynonyms
(5Z)2(4METHOXYPHENYL)5((4NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(4methoxyphenyl)5(4nitrobenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
2(4METHOXYPHENYL)5((4NITROPHENYL)METHYLIDENE)5H6H(124)TRIAZOLO(32B)(13)THIAZOL6ONE
COC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))SC3=N2
COc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(cc1)(N+)(=O)(O))s2
InChI=1SC18H12N4O4Sc126148412(5914)16191821(2016)17(23)15(2718)10112613(7311)22(24)25h210H1H3b1510
MFCD03532940
ZINC000016728752
ZINC16728752
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