Vitas-M small molecule compound
(5E)-2-(4-fluorophenyl)-5-(3-nitrobenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK704518
SMILES Fc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C\c1cccc(c1)[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 C17H9FN4O3S MW 368.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9FN4O3S/c18-12-6-4-11(5-7-12)15-19-17-21(20-15)16(23)14(26-17)9-10-2-1-3-13(8-10)22(24)25/h1-9H/b14-9+InChIKey
CXMSGQNBFFOBLX-NTEUORMPSA-NSynonyms
(5E)2(4FLUOROPHENYL)5((3NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)2(4fluorophenyl)5(3nitrobenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(4fluorophenyl)5(3nitrobenzylidene)thiazolo(32b)(124)triazol6(5H)one
C1=CC(=CC(=C1)(N+)(=O)(O))C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2
Fc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1cccc(c1)(N+)(=O)(O))s2
InChI=1SC17H9FN4O3Sc18126411(5712)15191721(2015)16(23)14(2617)91021313(810)22(24)25h19Hb149+
MFCD04446550
ZINC000001813109
ZINC01813109
ZINC1813109
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