Vitas-M small molecule compound

N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-1,3-thiazol-2-ylglycinamide

Catalog ID
STL542026
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)Nc2nccs2)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 C26H28N4O6S MW 524.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O6S/c1-14(31)29-18-7-5-15-11-21(34-2)24(35-3)25(36-4)23(15)16-6-8-19(20(32)12-17(16)18)28-13-22(33)30-26-27-9-10-37-26/h6,8-12,18H,5,7,13H2,1-4H3,(H,28,32)(H,29,31)(H,27,30,33)/t18-/m0/s1
InChIKey
KGFKFOBBETVZNM-SFHVURJKSA-N
Synonyms
1574391-30-2
(S)2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(thiazol2yl)acetamide
1574391302
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(13thiazol2yl)acetamide
75492364
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)Nc2nccs2)NC(=O)C)cc(c1OC)OC
InChI=1SC26H28N4O6Sc114(31)291875151121(342)24(353)25(364)23(15)166819(20(32)1217(16)18)281322(33)3026279103726h681218H5713H214H3(H2832)(H2931)(H273033)t18m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N13thiazol2ylglycinamide
ZINC000096222634
ZINC96222634

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Available files

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