Vitas-M small molecule compound
(5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK704079
SMILES [O-][N+](=O)c1cccc(c1)c1ccc(o1)/C=c\1/sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
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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/c28-22-20(11-15-8-9-16(32-15)13-4-3-5-14(10-13)27(29)30)34-23-24-21(25-26(22)23)19-12-31-17-6-1-2-7-18(17)33-19/h1-11,19H,12H2/b20-11+InChIKey
BZDBCHPPWBUUAK-RGVLZGJSSA-NSynonyms
(5E)2(23dihydro14benzodioxin2yl)5((5(3nitrophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)2(23dihydro14benzodioxin3yl)5((5(3nitrophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6one
(O)(N+)(=O)c1cccc(c1)c1ccc(o1)C=c1sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
C1C(OC2=CC=CC=C2O1)C3=NN4C(=O)C(=CC5=CC=C(O5)C6=CC(=CC=C6)(N+)(=O)(O))SC4=N3
InChI=1SC23H14N4O6Sc282220(11158916(3215)1343514(1013)27(29)30)34232421(2526(22)23)19123117612718(17)3319h11119H12H2b2011+
MFCD04446373
ZINC000016734193
ZINC000016734196
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