Vitas-M small molecule compound
N-[(7S)-10-{[2-(2-fluorophenyl)ethyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Catalog ID
STL533633
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCc2ccccc2F)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 C29H31FN2O5 MW 506.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31FN2O5/c1-17(33)32-23-11-9-19-15-26(35-2)28(36-3)29(37-4)27(19)20-10-12-24(25(34)16-21(20)23)31-14-13-18-7-5-6-8-22(18)30/h5-8,10,12,15-16,23H,9,11,13-14H2,1-4H3,(H,31,34)(H,32,33)/t23-/m0/s1InChIKey
AAVHROOWTUQFMU-QHCPKHFHSA-NSynonyms
1173688-94-2(S)N(10((2fluorophenethyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))10(2(2fluorophenyl)ethylamino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1173688942
6574873
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCc2ccccc2F)NC(=O)C)cc(c1OC)OC
InChI=1SC29H31FN2O5c117(33)3223119191526(352)28(363)29(374)27(19)20101224(25(34)1621(20)23)31141318756822(18)30h581012151623H9111314H214H3(H3134)(H3233)t23m0s1
N((7S)10((2(2fluorophenyl)ethyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
N((7S)10(2(2FLUOROPHENYL)ETHYLAMINO)123TRIMETHOXY9OXO67DIHYDRO5HBENZO(A)HEPTALEN7YL)ACETAMIDE
ZINC000012880195
ZINC12880195
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.