VITAS-M Laboratory logo VITAS‑M Laboratory COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
Vitas-M small molecule compound

N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-[(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[2]en]-3'-yl]-3-(4-hydroxy-3-methoxyphenyl)propanamide

Catalog ID
STL552119
SMILES COc1cc(ccc1O)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)N[C@H](c1nc2c([nH]1)cccc2)C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C35H34ClN3O9 MW 676.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34ClN3O9/c1-16-12-23(41)28(32(43)35(16)33(44)29-25(46-4)15-26(47-5)30(36)31(29)48-35)19(18-10-11-22(40)24(13-18)45-3)14-27(42)37-17(2)34-38-20-8-6-7-9-21(20)39-34/h6-11,13,15-17,19,40,43H,12,14H2,1-5H3,(H,37,42)(H,38,39)/t16-,17+,19?,35+/m1/s
InChIKey
PSWXYGGAORRYLJ-AWJAANIISA-N
Synonyms

~(N)((1~(S))1(1~(H)benzimidazol2yl)ethyl)3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)3(4hydroxy3methoxyphenyl)propanamide
132352288
COc1cc(ccc1O)C(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)N(C@H)(c1nc2c((nH)1)cccc2)C
InChI=1SC35H34ClN3O9c1161223(41)28(32(43)35(16)33(44)2925(464)1526(475)30(36)31(29)4835)19(18101122(40)24(1318)453)1427(42)3717(2)343820867921(20)3934h611131517194043H1214H215H3(H3742)(H3839)t1617+19?35+m1s1
N((1S)1(1Hbenzimidazol2yl)ethyl)3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)propanamide
N((S)1(1Hbenzo(d)imidazol2yl)ethyl)3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)propanamide
ZINC000824596336
ZINC000824596374

Check stock

See real-time availability and sample size for STL552119 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

Download SDF Download MOL 3D structure Download SDS