Vitas-M small molecule compound
N-[(7S)-1,2,3-trimethoxy-9-oxo-10-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]amino}-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Catalog ID
STL544651
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)N2CCN(CC2)c2ccccc2)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 C33H38N4O6 MW 586.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H38N4O6/c1-21(38)35-26-12-10-22-18-29(41-2)32(42-3)33(43-4)31(22)24-11-13-27(28(39)19-25(24)26)34-20-30(40)37-16-14-36(15-17-37)23-8-6-5-7-9-23/h5-9,11,13,18-19,26H,10,12,14-17,20H2,1-4H3,(H,34,39)(H,35,38)/t26-/m0/s1InChIKey
WCXUPSIKAZMNQJ-SANMLTNESA-NSynonyms
1574391-08-4(S)N(123trimethoxy9oxo10((2oxo2(4phenylpiperazin1yl)ethyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))123trimethoxy9oxo10((2oxo2(4phenylpiperazin1yl)ethyl)amino)67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1574391084
75491690
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)N2CCN(CC2)c2ccccc2)NC(=O)C)cc(c1OC)OC
InChI=1SC33H38N4O6c121(38)35261210221829(412)32(423)33(434)31(22)24111327(28(39)1925(24)26)342030(40)37161436(151737)238657923h591113181926H1012141720H214H3(H3439)(H3538)t26m0s1
N((7S)123trimethoxy9oxo10((2oxo2(4phenylpiperazin1yl)ethyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000108449264
ZINC108449264
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.