Vitas-M small molecule compound
(5Z)-5-[4-(benzyloxy)-3-methoxybenzylidene]-2-[4-(prop-2-en-1-yloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817711
SMILES C=CCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1ccc(c(c1)OC)OCc1ccccc1)/c2=O
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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 C28H23N3O4S MW 497.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O4S/c1-3-15-34-22-12-10-21(11-13-22)26-29-28-31(30-26)27(32)25(36-28)17-20-9-14-23(24(16-20)33-2)35-18-19-7-5-4-6-8-19/h3-14,16-17H,1,15,18H2,2H3/b25-17-InChIKey
RYTRVXAVHHFQLJ-UQQQWYQISA-NSynonyms
(5Z)5((3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2(4PROP2ENOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4(benzyloxy)3methoxybenzylidene)2(4(prop2en1yloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
C=CCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(c(c1)OC)OCc1ccccc1)c2=O
COC1=C(C=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC=C)S2)OCC5=CC=CC=C5
InChI=1SC28H23N3O4Sc13153422121021(111322)26292831(3026)27(32)25(3628)172091423(24(1620)332)3518197546819h3141617H11518H22H3b2517
MFCD06642992
ZINC000016736438
ZINC16736438
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