Vitas-M small molecule compound
2-[(5Z)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
Catalog ID
STK819024
SMILES CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)/c(=C/c1ccc(o1)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 C23H14N4O6S MW 474.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14N4O6S/c1-13(28)32-19-8-3-2-7-17(19)21-24-23-26(25-21)22(29)20(34-23)12-16-9-10-18(33-16)14-5-4-6-15(11-14)27(30)31/h2-12H,1H3/b20-12-InChIKey
GBMISKSYWQBYEJ-NDENLUEZSA-NSynonyms
(2((5Z)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
2((5Z)5((5(3nitrophenyl)furan2yl)methylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
CC(=O)OC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)(N+)(=O)(O))SC3=N2
CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)c(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))s2
InChI=1SC23H14N4O6Sc113(28)3219832717(19)21242326(2521)22(29)20(3423)121691018(3316)1454615(1114)27(30)31h212H1H3b2012
MFCD03532661
ZINC000002704550
ZINC02704550
ZINC2704550
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