Vitas-M small molecule compound
(5Z)-2-(2-bromophenyl)-5-(2-butoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK819919
SMILES CCCCOc1ccccc1/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1Br
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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 C21H18BrN3O2S MW 456.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN3O2S/c1-2-3-12-27-17-11-7-4-8-14(17)13-18-20(26)25-21(28-18)23-19(24-25)15-9-5-6-10-16(15)22/h4-11,13H,2-3,12H2,1H3/b18-13-InChIKey
IKYUINZRNDBJPT-AQTBWJFISA-NSynonyms
843633-45-4(5Z)2(2BROMOPHENYL)5((2BUTOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(2bromophenyl)5(2butoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(2bromophenyl)5(2butoxybenzylidene)thiazolo(32b)(124)triazol6(5H)one
843633454
CCCCOC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4Br)S2
CCCCOc1ccccc1C=c1sc2n(c1=O)nc(n2)c1ccccc1Br
InChI=1SC21H18BrN3O2Sc1231227171174814(17)131820(26)2521(2818)2319(2425)159561016(15)22h41113H2312H21H3b1813
MFCD04017042
ZINC000009459632
ZINC09459632
ZINC9459632
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