Vitas-M small molecule compound
(5E)-2-(2-methylphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK704140
SMILES Cc1ccccc1c1nc2n(n1)c(=O)/c(=C\c1ccc(o1)c1ccccc1[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 C22H14N4O4S MW 430.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N4O4S/c1-13-6-2-3-7-15(13)20-23-22-25(24-20)21(27)19(31-22)12-14-10-11-18(30-14)16-8-4-5-9-17(16)26(28)29/h2-12H,1H3/b19-12+InChIKey
OIFBRKRTRXGTJG-XDHOZWIPSA-NSynonyms
(5E)2(2methylphenyl)5((5(2nitrophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)2(2METHYLPHENYL)5((5(2NITROPHENYL)FURAN2YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((5(2nitrophenyl)furan2yl)methylene)2(otolyl)thiazolo(32b)(124)triazol6(5H)one
CC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O))SC3=N2
Cc1ccccc1c1nc2n(n1)c(=O)c(=Cc1ccc(o1)c1ccccc1(N+)(=O)(O))s2
InChI=1SC22H14N4O4Sc113623715(13)20232225(2420)21(27)19(3122)1214101118(3014)16845917(16)26(28)29h212H1H3b1912+
MFCD04512744
ZINC000026533650
ZINC26533650
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