Vitas-M small molecule compound
(2Z)-2-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxybenzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK727529
SMILES CCOc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)/C=c/1\sc2n(c1=O)c1c(n2)cccc1
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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 C30H30N2O4S MW 514.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O4S/c1-5-34-26-18-20(19-27-28(33)32-24-9-7-6-8-23(24)31-29(32)37-27)10-15-25(26)36-17-16-35-22-13-11-21(12-14-22)30(2,3)4/h6-15,18-19H,5,16-17H2,1-4H3/b27-19-InChIKey
DRMKNJDZBASEAY-DIBXZPPDSA-NSynonyms
(2Z)2((4(2(4TERTBUTYLPHENOXY)ETHOXY)3ETHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(4(2(4tertbutylphenoxy)ethoxy)3ethoxybenzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)OCCOC5=CC=C(C=C5)C(C)(C)C
CCOc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC30H30N2O4Sc1534261820(192728(33)3224976823(24)3129(32)3727)101525(26)3617163522131121(121422)30(23)4h6151819H51617H214H3b2719
MFCD03251999
ZINC000036089876
ZINC36089876
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