Vitas-M small molecule compound

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

Catalog ID
STK553808
SMILES CCCOc1ccc(cc1)c1nc2n(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 C24H18N4O5S MW 474.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N4O5S/c1-2-12-32-18-8-6-15(7-9-18)22-25-24-27(26-22)23(29)21(34-24)14-19-10-11-20(33-19)16-4-3-5-17(13-16)28(30)31/h3-11,13-14H,2,12H2,1H3/b21-14-
InChIKey
AOWOCUYHAFFKEG-STZFKDTASA-N
Synonyms
673490-16-9
(5Z)5((5(3nitrophenyl)furan2yl)methylidene)2(4propoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)2(4PROPOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((5(3nitrophenyl)furan2yl)methylene)2(4propoxyphenyl)thiazolo(32b)(124)triazol6(5H)one
673490169
CCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)(N+)(=O)(O))SC3=N2
CCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))s2
InChI=1SC24H18N4O5Sc121232188615(7918)22252427(2622)23(29)21(3424)1419101120(3319)1643517(1316)28(30)31h3111314H212H21H3b2114
MFCD04004781
ZINC000001838022
ZINC01838022
ZINC1838022

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Available files

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