Vitas-M small molecule compound

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

Catalog ID
STL541622
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)Nc2ncc(s2)C)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 C29H34N4O6S MW 566.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O6S/c1-16-15-31-29(40-16)33-25(36)7-6-12-30-22-11-9-19-20(14-23(22)35)21(32-17(2)34)10-8-18-13-24(37-3)27(38-4)28(39-5)26(18)19/h9,11,13-15,21H,6-8,10,12H2,1-5H3,(H,30,35)(H,32,34)(H,31,33,36)/t21-/m0/s1
InChIKey
YYHXKRGQALEHPQ-NRFANRHFSA-N
Synonyms
1574290-66-6
(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(5methylthiazol2yl)butanamide
1574290666
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(5methyl13thiazol2yl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(5methyl13thiazol2yl)butanamide
75491434
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)Nc2ncc(s2)C)NC(=O)C)cc(c1OC)OC
InChI=1SC29H34N4O6Sc116153129(4016)3325(36)761230221191920(1423(22)35)21(3217(2)34)108181324(373)27(384)28(395)26(18)19h911131521H681012H215H3(H3035)(H3234)(H313336)t21m0s1
ZINC000108448656
ZINC108448656

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Available files

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