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-(1,3-thiazol-2-yl)butanamide
Catalog ID
STL540765
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=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 C28H32N4O6S MW 552.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O6S/c1-16(33)31-20-9-7-17-14-23(36-2)26(37-3)27(38-4)25(17)18-8-10-21(22(34)15-19(18)20)29-11-5-6-24(35)32-28-30-12-13-39-28/h8,10,12-15,20H,5-7,9,11H2,1-4H3,(H,29,34)(H,31,33)(H,30,32,35)/t20-/m0/s1InChIKey
IBNMUDRPHAYIPX-FQEVSTJZSA-NSynonyms
1574355-40-0(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(thiazol2yl)butanamide
1574355400
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(13thiazol2yl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(13thiazol2yl)butanamide
75491446
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)Nc2nccs2)NC(=O)C)cc(c1OC)OC
InChI=1SC28H32N4O6Sc116(33)312097171423(362)26(373)27(384)25(17)1881021(22(34)1519(18)20)29115624(35)32283012133928h810121520H57911H214H3(H2934)(H3133)(H303235)t20m0s1
ZINC000108448673
ZINC108448673
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