Vitas-M small molecule compound
(5Z)-5-[4-(benzyloxy)benzylidene]-2-[(E)-2-phenylethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904032
SMILES O=c1/c(=C/c2ccc(cc2)OCc2ccccc2)/sc2n1nc(n2)/C=C/c1ccccc1
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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 C26H19N3O2S MW 437.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O2S/c30-25-23(17-20-11-14-22(15-12-20)31-18-21-9-5-2-6-10-21)32-26-27-24(28-29(25)26)16-13-19-7-3-1-4-8-19/h1-17H,18H2/b16-13+,23-17-InChIKey
DKJWXCUZSIWFSY-VWEQIBBSSA-NSynonyms
(5Z)2((E)2phenylethenyl)5((4phenylmethoxyphenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5Z)5(4(benzyloxy)benzylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C3C(=O)N4C(=NC(=N4)C=CC5=CC=CC=C5)S3
InChI=1SC26H19N3O2Sc302523(1720111422(151220)31182195261021)32262724(2829(25)26)1613197314819h117H18H2b1613+2317
MFCD18175403
O=c1c(=Cc2ccc(cc2)OCc2ccccc2)sc2n1nc(n2)C=Cc1ccccc1
ZINC000027021644
ZINC27021644
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