Vitas-M small molecule compound

(7Z)-3-(4-fluorophenyl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one

Catalog ID
STK859809
SMILES Fc1ccc(cc1)N1CN=c2n(C1)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 C18H13FN4O3S MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13FN4O3S/c19-13-4-6-14(7-5-13)21-10-20-18-22(11-21)17(24)16(27-18)9-12-2-1-3-15(8-12)23(25)26/h1-9H,10-11H2/b16-9-
InChIKey
XRQQYNFOLUWLDO-SXGWCWSVSA-N
Synonyms
690696-90-3
(7Z)3(4FLUOROPHENYL)7((3NITROPHENYL)METHYLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(7Z)3(4fluorophenyl)7(3nitrobenzylidene)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(Z)3(4fluorophenyl)7(3nitrobenzylidene)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
690696903
C1N=C2N(CN1C3=CC=C(C=C3)F)C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))S2
Fc1ccc(cc1)N1CN=c2n(C1)c(=O)c(=Cc1cccc(c1)(N+)(=O)(O))s2
InChI=1SC18H13FN4O3Sc19134614(7513)2110201822(1121)17(24)16(2718)91221315(812)23(25)26h19H1011H2b169
MFCD03687551
ZINC000001147303
ZINC01147303
ZINC1147303

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Available files

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