Vitas-M small molecule compound

(5Z)-2-(2-methoxyphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK705143
SMILES COc1ccccc1c1nc2n(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 C22H14N4O5S MW 446.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N4O5S/c1-30-17-9-5-3-7-15(17)20-23-22-25(24-20)21(27)19(32-22)12-13-10-11-18(31-13)14-6-2-4-8-16(14)26(28)29/h2-12H,1H3/b19-12-
InChIKey
MZMJDRSOFVAXQY-UNOMPAQXSA-N
Synonyms
578748-28-4
(5Z)2(2methoxyphenyl)5((5(2nitrophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(2METHOXYPHENYL)5((5(2NITROPHENYL)FURAN2YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(2methoxyphenyl)5((5(2nitrophenyl)furan2yl)methylene)thiazolo(32b)(124)triazol6(5H)one
578748284
COC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O))SC3=N2
COc1ccccc1c1nc2n(n1)c(=O)c(=Cc1ccc(o1)c1ccccc1(N+)(=O)(O))s2
InChI=1SC22H14N4O5Sc13017953715(17)20232225(2420)21(27)19(3222)1213101118(3113)14624816(14)26(28)29h212H1H3b1912
MFCD04024229
ZINC000013748951
ZINC13748951

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Available files

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