Vitas-M small molecule compound
(5Z)-2-(4-butoxyphenyl)-5-[4-(hexyloxy)-3-methoxybenzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK815922
SMILES CCCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)OCCCC
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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 C28H33N3O4S MW 507.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O4S/c1-4-6-8-9-17-35-23-15-10-20(18-24(23)33-3)19-25-27(32)31-28(36-25)29-26(30-31)21-11-13-22(14-12-21)34-16-7-5-2/h10-15,18-19H,4-9,16-17H2,1-3H3/b25-19-InChIKey
OGWZPCVSSALAHN-PLRJNAJWSA-NSynonyms
(5Z)2(4BUTOXYPHENYL)5((4HEXOXY3METHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(4butoxyphenyl)5(4(hexyloxy)3methoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCCCC)S2)OC
CCCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OCCCC
InChI=1SC28H33N3O4Sc14689173523151020(1824(23)333)192527(32)3128(3625)2926(3031)21111322(141221)3416752h10151819H491617H213H3b2519
MFCD03533401
ZINC000016732913
ZINC16732913
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