Vitas-M small molecule compound

1-(2-phenylethyl)-2-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-1H-benzimidazole

Catalog ID
STK112344
SMILES COc1cc(cc(c1OC)OC)c1nnc(o1)SCc1nc2c(n1CCc1ccccc1)cccc2

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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 C27H26N4O4S MW 502.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4S/c1-32-22-15-19(16-23(33-2)25(22)34-3)26-29-30-27(35-26)36-17-24-28-20-11-7-8-12-21(20)31(24)14-13-18-9-5-4-6-10-18/h4-12,15-16H,13-14,17H2,1-3H3
InChIKey
RCUGRAGSTJCBLV-UHFFFAOYSA-N
Synonyms

1(2PHENYLETHYL)2(((5(345TRIMETHOXYPHENYL)134OXADIAZOL2YL)SULFANYL)METHYL)1HBENZIMIDAZOLE
2((1(2phenylethyl)benzimidazol2yl)methylsulfanyl)5(345trimethoxyphenyl)134oxadiazole
2((1PHENETHYLBENZIMIDAZOL2YL)METHYLSULFANYL)5(345TRIMETHOXYPHENYL)134OXADIAZOLE
COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCC3=NC4=CC=CC=C4N3CCC5=CC=CC=C5
InChI=1SC27H26N4O4Sc132221519(1623(332)25(22)343)26293027(3526)361724282011781221(20)31(24)14131895461018h4121516H131417H213H3
MFCD03368424
ZINC000009763440
ZINC09763440
ZINC9763440

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Available files

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