Vitas-M small molecule compound
(2Z)-2-{3-chloro-5-ethoxy-4-[2-(4-hexylphenoxy)ethoxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK096506
SMILES CCCCCCc1ccc(cc1)OCCOc1c(Cl)cc(cc1OCC)/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 C32H33ClN2O4S MW 577.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33ClN2O4S/c1-3-5-6-7-10-22-13-15-24(16-14-22)38-17-18-39-30-25(33)19-23(20-28(30)37-4-2)21-29-31(36)35-27-12-9-8-11-26(27)34-32(35)40-29/h8-9,11-16,19-21H,3-7,10,17-18H2,1-2H3/b29-21-InChIKey
PNMHFDSLSYZUMS-ANYBSYGZSA-NSynonyms
(2Z)2((3CHLORO5ETHOXY4(2(4HEXYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(3CHLORO5ETHOXY4(2(4HEXYLPHENOXY)ETHOXY)BENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
CCCCCCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Cl)C=C3C(=O)N4C5=CC=CC=C5N=C4S3)OCC
CCCCCCc1ccc(cc1)OCCOc1c(Cl)cc(cc1OCC)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC32H33ClN2O4Sc135671022131524(161422)381718393025(33)1923(2028(30)3742)212931(36)352712981126(27)3432(35)4029h8911161921H37101718H212H3b2921
MFCD03227940
STK096506
ZINC000097959418
ZINC97959418
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