Vitas-M small molecule compound

(E)-1-(4-tert-butylphenyl)-2-[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]ethenyl 4-tert-butylbenzoate

Catalog ID
STK700659
SMILES Clc1ccc(cc1)Cn1c(/C=C(\c2ccc(cc2)C(C)(C)C)/OC(=O)c2ccc(cc2)C(C)(C)C)nc2c1cccc2

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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 C37H37ClN2O2 MW 577.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H37ClN2O2/c1-36(2,3)28-17-13-26(14-18-28)33(42-35(41)27-15-19-29(20-16-27)37(4,5)6)23-34-39-31-9-7-8-10-32(31)40(34)24-25-11-21-30(38)22-12-25/h7-23H,24H2,1-6H3/b33-23+
InChIKey
ADQFGHHQNKYWNP-GZZLJNBRSA-N
Synonyms

((E)1(4TERTBUTYLPHENYL)2(1((4CHLOROPHENYL)METHYL)BENZIMIDAZOL2YL)ETHENYL)4TERTBUTYLBENZOATE
(E)1(4(tertbutyl)phenyl)2(1(4chlorobenzyl)1Hbenzo(d)imidazol2yl)vinyl4(tertbutyl)benzoate
(E)1(4tertbutylphenyl)2(1(4chlorobenzyl)1Hbenzimidazol2yl)ethenyl4tertbutylbenzoate
CC(C)(C)C1=CC=C(C=C1)C(=CC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl)OC(=O)C5=CC=C(C=C5)C(C)(C)C
Clc1ccc(cc1)Cn1c(C=C(c2ccc(cc2)C(C)(C)C)OC(=O)c2ccc(cc2)C(C)(C)C)nc2c1cccc2
InChI=1SC37H37ClN2O2c136(23)28171326(141828)33(4235(41)27151929(201627)37(45)6)233439319781032(31)40(34)2425112130(38)221225h723H24H216H3b3323+
MFCD01816621
ZINC000097968833
ZINC97968833

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Available files

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