Vitas-M small molecule compound
(5Z)-5-(4-ethylbenzylidene)-2-[4-(prop-2-en-1-yloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK818311
SMILES C=CCOc1ccc(cc1)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 C22H19N3O2S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O2S/c1-3-13-27-18-11-9-17(10-12-18)20-23-22-25(24-20)21(26)19(28-22)14-16-7-5-15(4-2)6-8-16/h3,5-12,14H,1,4,13H2,2H3/b19-14-InChIKey
ZEZBOBUWISPJSN-RGEXLXHISA-NSynonyms
(5Z)5((4ETHYLPHENYL)METHYLIDENE)2(4PROP2ENOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4ethylbenzylidene)2(4(prop2en1yloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
C=CCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(cc1)CC)c2=O
CCC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC=C)S2
InChI=1SC22H19N3O2Sc1313271811917(101218)20232225(2420)21(26)19(2822)14167515(42)6816h351214H1413H22H3b1914
MFCD04447829
ZINC000016736789
ZINC16736789
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