Vitas-M small molecule compound
6-{[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[(2Z)-4-(pyridin-2-yl)-1,3-thiazol-2(3H)-ylidene]hexanamide
Catalog ID
STL544523
SMILES COc1c2c(CCC(c3c2ccc(c(=O)c3)NCCCCCC(=O)/N=c/2\scc([nH]2)c2ccccn2)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 C35H39N5O6S MW 657.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H39N5O6S/c1-21(41)38-25-14-12-22-18-30(44-2)33(45-3)34(46-4)32(22)23-13-15-27(29(42)19-24(23)25)37-16-8-5-6-11-31(43)40-35-39-28(20-47-35)26-10-7-9-17-36-26/h7,9-10,13,15,17-20,25H,5-6,8,11-12,14,16H2,1-4H3,(H,37,42)(H,38,41)(H,39,40,43)InChIKey
STJZGZLMQQHTDA-UHFFFAOYSA-NSynonyms
110209749
6((7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((2Z)4(pyridin2yl)13thiazol2(3H)ylidene)hexanamide
6((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(4pyridin2yl13thiazol2yl)hexanamide
InChI=1SC35H39N5O6Sc121(41)38251412221830(442)33(453)34(464)32(22)23131527(29(42)1924(23)25)37168561131(43)40353928(204735)261079173626h79101315172025H56811121416H214H3(H3742)(H3841)(H394043)
MFCD31756063
ZINC000150653465
ZINC000252550564
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