Vitas-M small molecule compound
(5Z)-5-(4-ethylbenzylidene)-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800961
SMILES COc1cc(cc(c1OC)OC)c1nn2c(n1)s/c(=C\c1ccc(cc1)CC)/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 C22H21N3O4S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S/c1-5-13-6-8-14(9-7-13)10-18-21(26)25-22(30-18)23-20(24-25)15-11-16(27-2)19(29-4)17(12-15)28-3/h6-12H,5H2,1-4H3/b18-10-InChIKey
OVJFKYJCVIIABT-ZDLGFXPLSA-NSynonyms
587012-12-2(5Z)5((4ETHYLPHENYL)METHYLIDENE)2(345TRIMETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4ethylbenzylidene)2(345trimethoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(4ethylbenzylidene)2(345trimethoxyphenyl)thiazolo(32b)(124)triazol6(5H)one
587012122
CCC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC(=C(C(=C4)OC)OC)OC)S2
COc1cc(cc(c1OC)OC)c1nn2c(n1)sc(=Cc1ccc(cc1)CC)c2=O
InChI=1SC22H21N3O4Sc15136814(9713)101821(26)2522(3018)2320(2425)151116(272)19(294)17(1215)283h612H5H214H3b1810
MFCD04034259
ZINC000002399251
ZINC02399251
ZINC2399251
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