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4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]butanamide

Catalog ID
STL547639
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)Nc2scc(n2)c2c[nH]c3c2cccc3)NC(=O)C)cc(c1OC)OC

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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 C36H37N5O6S MW 667.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H37N5O6S/c1-20(42)39-27-13-11-21-16-31(45-2)34(46-3)35(47-4)33(21)23-12-14-28(30(43)17-24(23)27)37-15-7-10-32(44)41-36-40-29(19-48-36)25-18-38-26-9-6-5-8-22(25)26/h5-6,8-9,12,14,16-19,27,38H,7,10-11,13,15H2,1-4H3,(H,37,43)(H,39,42)(H,40,41,44)
InChIKey
QFXJHMWNOQZTND-MHZLTWQESA-N
Synonyms
1676107-83-7
(S)N(4(1Hindol3yl)thiazol2yl)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)butanamide
100005019
1676107837
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(4(1~(H)indol3yl)13thiazol2yl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(4(1Hindol3yl)13thiazol2yl)butanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)Nc2scc(n2)c2c(nH)c3c2cccc3)NC(=O)C)cc(c1OC)OC
InChI=1SC36H37N5O6Sc120(42)39271311211631(452)34(463)35(474)33(21)23121428(30(43)1724(23)27)371571032(44)41364029(194836)25183826965822(25)26h5689121416192738H710111315H214H3(H3743)(H3942)(H404144)t27m0s1
ZINC000218126508
ZINC218126508

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Available files

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