Vitas-M small molecule compound
(2Z)-2-(4-{2-[2-(butan-2-yl)phenoxy]ethoxy}benzylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK084450
SMILES CCC(c1ccccc1OCCOc1ccc(cc1)/C=c/1\sc2n(c1=O)c1c(n2)cccc1)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 C28H26N2O3S MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O3S/c1-3-19(2)22-8-4-7-11-25(22)33-17-16-32-21-14-12-20(13-15-21)18-26-27(31)30-24-10-6-5-9-23(24)29-28(30)34-26/h4-15,18-19H,3,16-17H2,1-2H3/b26-18-InChIKey
NBKZTGWUACCLKX-ITYLOYPMSA-NSynonyms
(2Z)2((4(2(2BUTAN2YLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(4(2(2(BUTAN2YL)PHENOXY)ETHOXY)BENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
CCC(C)C1=CC=CC=C1OCCOC2=CC=C(C=C2)C=C3C(=O)N4C5=CC=CC=C5N=C4S3
CCC(c1ccccc1OCCOc1ccc(cc1)C=c1sc2n(c1=O)c1c(n2)cccc1)C
InChI=1SC28H26N2O3Sc1319(2)228471125(22)3317163221141220(131521)182627(31)30241065923(24)2928(30)3426h4151819H31617H212H3b2618
MFCD05975711
STK084450
ZINC000009679064
ZINC000009679883
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