Vitas-M small molecule compound
(5E)-5-[4-(pentyloxy)benzylidene]-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK702621
SMILES CCCCCOc1ccc(cc1)/C=c\1/sc2n(c1=O)nc(n2)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 C22H21N3O2S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2S/c1-2-3-7-14-27-18-12-10-16(11-13-18)15-19-21(26)25-22(28-19)23-20(24-25)17-8-5-4-6-9-17/h4-6,8-13,15H,2-3,7,14H2,1H3/b19-15+InChIKey
BHOCOIFKQLQWJP-XDJHFCHBSA-NSynonyms
(5E)5((4PENTOXYPHENYL)METHYLIDENE)2PHENYL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(4(pentyloxy)benzylidene)2phenyl(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(4(pentyloxy)benzylidene)2phenylthiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4)S2
CCCCCOc1ccc(cc1)C=c1sc2n(c1=O)nc(n2)c1ccccc1
InChI=1SC22H21N3O2Sc1237142718121016(111318)151921(26)2522(2819)2320(2425)178546917h4681315H23714H21H3b1915+
MFCD03225761
ZINC000001834661
ZINC01834661
ZINC1834661
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