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N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-{2-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]ethyl}-L-methioninamide

Catalog ID
STL551100
SMILES CSCC[C@@H](C(=O)NCCc1onc(n1)c1ccccn1)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C35H40N6O7S MW 688.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H40N6O7S/c1-20(42)38-24-11-9-21-18-29(45-2)32(46-3)33(47-4)31(21)22-10-12-25(28(43)19-23(22)24)39-27(14-17-49-5)35(44)37-16-13-30-40-34(41-48-30)26-8-6-7-15-36-26/h6-8,10,12,15,18-19,24,27H,9,11,13-14,16-17H2,1-5H3,(H,37,44)(H,38,42)(H,39,43)/
InChIKey
HCDNEVRDTKQZSO-IGKIAQTJSA-N
Synonyms

(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanyl~(N)(2(3pyridin2yl124oxadiazol5yl)ethyl)butanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4(methylthio)N(2(3(pyridin2yl)124oxadiazol5yl)ethyl)butanamide
125430289
CSCC(C@@H)(C(=O)NCCc1onc(n1)c1ccccn1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC35H40N6O7Sc120(42)3824119211829(452)32(463)33(474)31(21)22101225(28(43)1923(22)24)3927(1417495)35(44)371613304034(414830)26867153626h6810121518192427H91113141617H215H3(H3744)(H3842)(H3943)t2427m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(3(pyridin2yl)124oxadiazol5yl)ethyl)Lmethioninamide
ZINC000524731676
ZINC524731676

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Available files

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