Vitas-M small molecule compound
(5Z)-2-(4-tert-butylphenyl)-5-[3-ethoxy-4-(pentyloxy)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK706070
SMILES CCCCCOc1ccc(cc1OCC)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)C
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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 C28H33N3O3S MW 491.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O3S/c1-6-8-9-16-34-22-15-10-19(17-23(22)33-7-2)18-24-26(32)31-27(35-24)29-25(30-31)20-11-13-21(14-12-20)28(3,4)5/h10-15,17-18H,6-9,16H2,1-5H3/b24-18-InChIKey
OXZZZKDMCIOROR-MOHJPFBDSA-NSynonyms
861118-74-3(5Z)2(4TERTBUTYLPHENYL)5((3ETHOXY4PENTOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2(4tertbutylphenyl)5(3ethoxy4(pentyloxy)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(4(tertbutyl)phenyl)5(3ethoxy4(pentyloxy)benzylidene)thiazolo(32b)(124)triazol6(5H)one
861118743
CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)C(C)(C)C)S2)OCC
CCCCCOc1ccc(cc1OCC)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)C
InChI=1SC28H33N3O3Sc1689163422151019(1723(22)3372)182426(32)3127(3524)2925(3031)20111321(141220)28(34)5h10151718H6916H215H3b2418
MFCD03665171
ZINC000009307632
ZINC09307632
ZINC9307632
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