Vitas-M small molecule compound
(7Z)-3-(1,3-benzodioxol-5-yl)-7-(4-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Catalog ID
STL011975
SMILES [O-][N+](=O)c1ccc(cc1)/C=c/1\sc2=NCN(Cn2c1=O)c1ccc2c(c1)OCO2
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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 C19H14N4O5S MW 410.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N4O5S/c24-18-17(7-12-1-3-13(4-2-12)23(25)26)29-19-20-9-21(10-22(18)19)14-5-6-15-16(8-14)28-11-27-15/h1-8H,9-11H2/b17-7-InChIKey
KGDLAIRVLPXZAY-IDUWFGFVSA-NSynonyms
499210-71-8(7Z)3(13BENZODIOXOL5YL)7((4NITROPHENYL)METHYLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(7Z)3(13benzodioxol5yl)7(4nitrobenzylidene)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(O)(N+)(=O)c1ccc(cc1)C=c1sc2=NCN(Cn2c1=O)c1ccc2c(c1)OCO2
(Z)3(benzo(d)(13)dioxol5yl)7(4nitrobenzylidene)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
499210718
C1N=C2N(CN1C3=CC4=C(C=C3)OCO4)C(=O)C(=CC5=CC=C(C=C5)(N+)(=O)(O))S2
InChI=1SC19H14N4O5Sc241817(7121313(4212)23(25)26)291920921(1022(18)19)14561516(814)28112715h18H911H2b177
MFCD03303766
ZINC000013617674
ZINC13617674
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