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-[(2E)-4-(1H-indol-3-yl)-1,3-thiazol-2(3H)-ylidene]hexanamide

Catalog ID
STL544119
SMILES COc1cc2CCC(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCCCC(=O)/N=c\1/scc([nH]1)c1c[nH]c2c1cccc2)NC(=O)C

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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 C38H41N5O6S MW 695.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H41N5O6S/c1-22(44)41-29-15-13-23-18-33(47-2)36(48-3)37(49-4)35(23)25-14-16-30(32(45)19-26(25)29)39-17-9-5-6-12-34(46)43-38-42-31(21-50-38)27-20-40-28-11-8-7-10-24(27)28/h7-8,10-11,14,16,18-21,29,40H,5-6,9,12-13,15,17H2,1-4H3,(H,39,45)(H,41,44)
InChIKey
SIFLEXXDKBPDPL-UHFFFAOYSA-N
Synonyms

110209975
6((7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((2E)4(1Hindol3yl)13thiazol2(3H)ylidene)hexanamide
6((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(4(1~(H)indol3yl)13thiazol2yl)hexanamide
InChI=1SC38H41N5O6Sc122(44)41291513231833(472)36(483)37(494)35(23)25141630(32(45)1926(25)29)39179561234(46)43384231(215038)2720402811871024(27)28h781011141618212940H56912131517H214H3(H3945)(H4144)(H424346)
MFCD31755984
ZINC000217876437
ZINC000252550317

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Available files

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