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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-(1H-benzimidazol-2-yl)ethyl]-L-methioninamide

Catalog ID
STL541601
SMILES CSCC[C@@H](C(=O)NCCc1nc2c([nH]1)cccc2)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 C35H41N5O6S MW 659.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H41N5O6S/c1-20(41)37-24-12-10-21-18-30(44-2)33(45-3)34(46-4)32(21)22-11-13-27(29(42)19-23(22)24)38-28(15-17-47-5)35(43)36-16-14-31-39-25-8-6-7-9-26(25)40-31/h6-9,11,13,18-19,24,28H,10,12,14-17H2,1-5H3,(H,36,43)(H,37,41)(H,38,42)(H,39,40)/t24-,
InChIKey
HGONMCQJTYSXTG-CUBQBAPOSA-N
Synonyms
1574355-22-8
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(1~(H)benzimidazol2yl)ethyl)4methylsulfanylbutanamide
(S)N(2(1Hbenzo(d)imidazol2yl)ethyl)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4(methylthio)butanamide
1574355228
75491357
CSCC(C@@H)(C(=O)NCCc1nc2c((nH)1)cccc2)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC35H41N5O6Sc120(41)37241210211830(442)33(453)34(464)32(21)22111327(29(42)1923(22)24)3828(1517475)35(43)361614313925867926(25)4031h69111318192428H10121417H215H3(H3643)(H3741)(H3842)(H3940)t2428m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(1Hbenzimidazol2yl)ethyl)Lmethioninamide
ZINC000150653168
ZINC150653168

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Available files

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